[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate

C305H298F68O58 — CID 161117950

IUPAC[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
SMILESCCC1(COCCCCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)COC1.CCC1(COCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)c(F)c4)cc3)cc2)COC1.CCC1(COCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)c(F)c4)cc3)cc2)COC1.CCC1(COc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1
InChIInChI=1S/C36H31F23O6.C34H31F19O6.C34H39F3O6.C32H35F3O6.C31H33F3O6.C30H31F3O6.C28H26F4O6.C28H27F3O6.C26H22F4O5.C26H23F3O5/c1-2-25(18-62-19-25)17-61-15-5-3-4-6-16-63-21-9-7-20(8-10-21)24(60)64-22-11-13-23(14-12-22)65-36(58,59)34(53,54)32(49,50)30(45,46)28(41,42)26(37,38)27(39,40)29(43,44)31(47,48)33(51,52)35(55,56)57;1-2-25(18-56-19-25)17-55-15-5-3-4-6-16-57-21-9-7-20(8-10-21)24(54)58-22-11-13-23(14-12-22)59-34(52,53)32(47,48)30(43,44)28(39,40)26(35,36)27(37,38)29(41,42)31(45,46)33(49,50)51;1-2-33(24-40-25-33)23-39-21-7-5-3-4-6-8-22-41-29-15-13-28(14-16-29)32(38)42-30-17-9-26(10-18-30)27-11-19-31(20-12-27)43-34(35,36)37;1-2-31(22-38-23-31)21-37-19-5-3-4-6-20-39-27-13-11-26(12-14-27)30(36)40-28-15-7-24(8-16-28)25-9-17-29(18-10-25)41-32(33,34)35;1-2-30(21-37-22-30)20-36-18-4-3-5-19-38-26-12-10-25(11-13-26)29(35)39-27-14-6-23(7-15-27)24-8-16-28(17-9-24)40-31(32,33)34;1-2-29(20-36-21-29)19-35-17-3-4-18-37-25-11-9-24(10-12-25)28(34)38-26-13-5-22(6-14-26)23-7-15-27(16-8-23)39-30(31,32)33;1-2-27(17-35-18-27)16-34-13-14-36-22-8-5-20(6-9-22)26(33)37-23-10-3-19(4-11-23)21-7-12-25(24(29)15-21)38-28(30,31)32;1-2-27(18-34-19-27)17-33-15-16-35-23-9-7-22(8-10-23)26(32)36-24-11-3-20(4-12-24)21-5-13-25(14-6-21)37-28(29,30)31;1-2-25(14-32-15-25)16-33-20-8-5-18(6-9-20)24(31)34-21-10-3-17(4-11-21)19-7-12-23(22(27)13-19)35-26(28,29)30;1-2-25(15-31-16-25)17-32-21-9-7-20(8-10-21)24(30)33-22-11-3-18(4-12-22)19-5-13-23(14-6-19)34-26(27,28)29/h7-14H,2-6,15-19H2,1H3;7-14H,2-6,15-19H2,1H3;9-20H,2-8,21-25H2,1H3;7-18H,2-6,19-23H2,1H3;6-17H,2-5,18-22H2,1H3;5-16H,2-4,17-21H2,1H3;3-12,15H,2,13-14,16-18H2,1H3;3-14H,2,15-19H2,1H3;3-13H,2,14-16H2,1H3;3-14H,2,15-17H2,1H3
InChIKeyUKOJHOBDXAMGTM-UHFFFAOYSA-N
MW6183.55 g/mol
LogP80.25
Rot. Bonds143

About [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate

[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate (PubChem CID 161117950) has the molecular formula C305H298F68O58 and a molecular weight of 6183.55 g/mol. Its IUPAC name is [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate.

Molecular Properties

Compound Name[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
PubChem CID161117950
Molecular FormulaC305H298F68O58
Molecular Weight6183.55 g/mol
Exact Mass6179.93
IUPAC Name[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
SMILESCCC1(COCCCCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)COC1.CCC1(COCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)c(F)c4)cc3)cc2)COC1.CCC1(COCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)c(F)c4)cc3)cc2)COC1.CCC1(COc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1
InChIInChI=1S/C36H31F23O6.C34H31F19O6.C34H39F3O6.C32H35F3O6.C31H33F3O6.C30H31F3O6.C28H26F4O6.C28H27F3O6.C26H22F4O5.C26H23F3O5/c1-2-25(18-62-19-25)17-61-15-5-3-4-6-16-63-21-9-7-20(8-10-21)24(60)64-22-11-13-23(14-12-22)65-36(58,59)34(53,54)32(49,50)30(45,46)28(41,42)26(37,38)27(39,40)29(43,44)31(47,48)33(51,52)35(55,56)57;1-2-25(18-56-19-25)17-55-15-5-3-4-6-16-57-21-9-7-20(8-10-21)24(54)58-22-11-13-23(14-12-22)59-34(52,53)32(47,48)30(43,44)28(39,40)26(35,36)27(37,38)29(41,42)31(45,46)33(49,50)51;1-2-33(24-40-25-33)23-39-21-7-5-3-4-6-8-22-41-29-15-13-28(14-16-29)32(38)42-30-17-9-26(10-18-30)27-11-19-31(20-12-27)43-34(35,36)37;1-2-31(22-38-23-31)21-37-19-5-3-4-6-20-39-27-13-11-26(12-14-27)30(36)40-28-15-7-24(8-16-28)25-9-17-29(18-10-25)41-32(33,34)35;1-2-30(21-37-22-30)20-36-18-4-3-5-19-38-26-12-10-25(11-13-26)29(35)39-27-14-6-23(7-15-27)24-8-16-28(17-9-24)40-31(32,33)34;1-2-29(20-36-21-29)19-35-17-3-4-18-37-25-11-9-24(10-12-25)28(34)38-26-13-5-22(6-14-26)23-7-15-27(16-8-23)39-30(31,32)33;1-2-27(17-35-18-27)16-34-13-14-36-22-8-5-20(6-9-22)26(33)37-23-10-3-19(4-11-23)21-7-12-25(24(29)15-21)38-28(30,31)32;1-2-27(18-34-19-27)17-33-15-16-35-23-9-7-22(8-10-23)26(32)36-24-11-3-20(4-12-24)21-5-13-25(14-6-21)37-28(29,30)31;1-2-25(14-32-15-25)16-33-20-8-5-18(6-9-20)24(31)34-21-10-3-17(4-11-21)19-7-12-23(22(27)13-19)35-26(28,29)30;1-2-25(15-31-16-25)17-32-21-9-7-20(8-10-21)24(30)33-22-11-3-18(4-12-22)19-5-13-23(14-6-19)34-26(27,28)29/h7-14H,2-6,15-19H2,1H3;7-14H,2-6,15-19H2,1H3;9-20H,2-8,21-25H2,1H3;7-18H,2-6,19-23H2,1H3;6-17H,2-5,18-22H2,1H3;5-16H,2-4,17-21H2,1H3;3-12,15H,2,13-14,16-18H2,1H3;3-14H,2,15-19H2,1H3;3-13H,2,14-16H2,1H3;3-14H,2,15-17H2,1H3
InChIKeyUKOJHOBDXAMGTM-UHFFFAOYSA-N
XLogP80.25
TPSA613.74 Ų
H-Bond Donors
H-Bond Acceptors58
Rotatable Bonds143
Heavy Atoms431
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006183.55
LogP ≤ 580.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1058

Analyze [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate with MolForge

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Related Compounds

[4-(trifluoromethoxy)phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
CID 59767509
[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-methyloxetan-3-yl)methoxy]ethoxy]benzoate
CID 59767565
[4-[4-[4-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxy-3-fluorophenyl]-3-fluorophenyl]-2-fluorophenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate
CID 163605741
[4-(trifluoromethoxy)phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate
CID 59767520
[4-[4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoyl]oxyphenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
CID 102214597
[3-fluoro-4-(trifluoromethoxy)phenyl] 4-[8-[(3-methyloxetan-3-yl)methoxy]octoxy]benzoate
CID 59767552
[9,9-dimethyl-7-[4-(trifluoromethoxy)benzoyl]oxyfluoren-2-yl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate
CID 58586858
[3-fluoro-4-(trifluoromethoxy)phenyl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
CID 59767563
[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-methyloxetan-3-yl)methoxy]hexoxy]benzoate
CID 59767593
[3-fluoro-4-(trifluoromethoxy)phenyl] 3-[4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]phenyl]propanoate
CID 59767519
[3-fluoro-4-(trifluoromethoxy)phenyl] 4-[3-[(3-methyloxetan-3-yl)methoxy]propoxy]benzoate
CID 59767531
[4-(trifluoromethoxy)phenyl] 4-[8-[(3-methyloxetan-3-yl)methoxy]octoxy]benzoate
CID 59767499

Frequently Asked Questions

What is the IUPAC name of [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate?
The IUPAC name of [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate (CID 161117950) is [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate.
What is the SMILES notation for [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate?
The canonical SMILES for [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate is CCC1(COCCCCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)COC1.CCC1(COCCCCCCOc2ccc(C(=O)Oc3ccc(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)cc2)COC1.CCC1(COCCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)c(F)c4)cc3)cc2)COC1.CCC1(COCCOc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.CCC1(COc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)c(F)c4)cc3)cc2)COC1.CCC1(COc2ccc(C(=O)Oc3ccc(-c4ccc(OC(F)(F)F)cc4)cc3)cc2)COC1.
What is the InChIKey of [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate?
The InChIKey is UKOJHOBDXAMGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H31F23O6.C34H31F19O6.C34H39F3O6.C32H35F3O6.C31H33F3O6.C30H31F3O6.C28H26F4O6.C28H27F3O6.C26H22F4O5.C26H23F3O5/c1-2-25(18-62-19-25)17-61-15-5-3-4-6-16-63-21-9-7-20(8-10-21)24(60)64-22-11-13-23(14-12-22)65-36(58,59)34(53,54)32(49,50)30(45,46)28(41,42)26(37,38)27(39,40)29(43,44)31(47,48)33(51,52)35(55,56)57;1-2-25(18-56-19-25)17-55-15-5-3-4-6-16-57-21-9-7-20(8-10-21)24(54)58-22-11-13-23(14-12-22)59-34(52,53)32(47,48)30(43,44)28(39,40)26(35,36)27(37,38)29(41,42)31(45,46)33(49,50)51;1-2-33(24-40-25-33)23-39-21-7-5-3-4-6-8-22-41-29-15-13-28(14-16-29)32(38)42-30-17-9-26(10-18-30)27-11-19-31(20-12-27)43-34(35,36)37;1-2-31(22-38-23-31)21-37-19-5-3-4-6-20-39-27-13-11-26(12-14-27)30(36)40-28-15-7-24(8-16-28)25-9-17-29(18-10-25)41-32(33,34)35;1-2-30(21-37-22-30)20-36-18-4-3-5-19-38-26-12-10-25(11-13-26)29(35)39-27-14-6-23(7-15-27)24-8-16-28(17-9-24)40-31(32,33)34;1-2-29(20-36-21-29)19-35-17-3-4-18-37-25-11-9-24(10-12-25)28(34)38-26-13-5-22(6-14-26)23-7-15-27(16-8-23)39-30(31,32)33;1-2-27(17-35-18-27)16-34-13-14-36-22-8-5-20(6-9-22)26(33)37-23-10-3-19(4-11-23)21-7-12-25(24(29)15-21)38-28(30,31)32;1-2-27(18-34-19-27)17-33-15-16-35-23-9-7-22(8-10-23)26(32)36-24-11-3-20(4-12-24)21-5-13-25(14-6-21)37-28(29,30)31;1-2-25(14-32-15-25)16-33-20-8-5-18(6-9-20)24(31)34-21-10-3-17(4-11-21)19-7-12-23(22(27)13-19)35-26(28,29)30;1-2-25(15-31-16-25)17-32-21-9-7-20(8-10-21)24(30)33-22-11-3-18(4-12-22)19-5-13-23(14-6-19)34-26(27,28)29/h7-14H,2-6,15-19H2,1H3;7-14H,2-6,15-19H2,1H3;9-20H,2-8,21-25H2,1H3;7-18H,2-6,19-23H2,1H3;6-17H,2-5,18-22H2,1H3;5-16H,2-4,17-21H2,1H3;3-12,15H,2,13-14,16-18H2,1H3;3-14H,2,15-19H2,1H3;3-13H,2,14-16H2,1H3;3-14H,2,15-17H2,1H3.
What are the key properties of [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate?
[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate has a molecular weight of 6183.55 g/mol, XLogP of 80.25, 143 rotatable bonds, 0 hydrogen bond donors, and 58 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-tricosafluoroundecoxy)phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[8-[(3-ethyloxetan-3-yl)methoxy]octoxy]benzoate;[4-[4-(trifluoromethoxy)phenyl]phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate is sourced from PubChem (CID 161117950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).