[9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate

C207H234F5NO28 — CID 158279802

IUPAC[9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
SMILESCC1(COCCCCOc2ccc(C(=O)Oc3ccc4c(c3)C(F)(F)c3cc(OC(F)(F)F)ccc3-4)cc2)COC1.CCCCCCCCOc1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.CCCCCc1ccc2c(c1)C(C)c1cc(C#Cc3ccc(OCCCCCCOCC4(CC)COC4)cc3)ccc1-2.CCCCCc1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.CCCc1ccc2c(c1)Cc1cc(C#Cc3ccc(OCCCCCCOCC4(CC)COC4)cc3)ccc1-2.[C-]#[N+]c1ccc2c(c1)C(C)c1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2
InChIInChI=1S/C39H48O3.C37H46O6.C36H42O3.C34H40O5.C31H31NO5.C30H27F5O6/c1-4-6-9-12-32-17-21-35-36-22-18-33(26-38(36)30(3)37(35)25-32)14-13-31-15-19-34(20-16-31)42-24-11-8-7-10-23-40-27-39(5-2)28-41-29-39;1-3-4-5-6-7-8-20-42-32-15-17-34-29(23-32)22-30-24-33(16-18-35(30)34)43-36(38)28-11-13-31(14-12-28)41-21-10-9-19-39-25-37(2)26-40-27-37;1-3-9-29-14-18-34-31(22-29)24-32-23-30(15-19-35(32)34)11-10-28-12-16-33(17-13-28)39-21-8-6-5-7-20-37-25-36(4-2)26-38-27-36;1-3-4-5-8-25-9-15-31-27(19-25)20-28-21-30(14-16-32(28)31)39-33(35)26-10-12-29(13-11-26)38-18-7-6-17-36-22-34(2)23-37-24-34;1-21-28-16-23(32-3)8-12-26(28)27-13-11-25(17-29(21)27)37-30(33)22-6-9-24(10-7-22)36-15-5-4-14-34-18-31(2)19-35-20-31;1-28(17-38-18-28)16-37-12-2-3-13-39-20-6-4-19(5-7-20)27(36)40-21-8-10-23-24-11-9-22(41-30(33,34)35)15-26(24)29(31,32)25(23)14-21/h15-22,25-26,30H,4-12,23-24,27-29H2,1-3H3;11-18,23-24H,3-10,19-22,25-27H2,1-2H3;12-19,22-23H,3-9,20-21,24-27H2,1-2H3;9-16,19,21H,3-8,17-18,20,22-24H2,1-2H3;6-13,16-17,21H,4-5,14-15,18-20H2,1-2H3;4-11,14-15H,2-3,12-13,16-18H2,1H3
InChIKeyGKBOPZHVMXYOQB-UHFFFAOYSA-N
MW3279.12 g/mol
LogP47.11
Rot. Bonds81

About [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate

[9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate (PubChem CID 158279802) has the molecular formula C207H234F5NO28 and a molecular weight of 3279.12 g/mol. Its IUPAC name is [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate.

Molecular Properties

Compound Name[9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
PubChem CID158279802
Molecular FormulaC207H234F5NO28
Molecular Weight3279.12 g/mol
Exact Mass3276.68
IUPAC Name[9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate
SMILESCC1(COCCCCOc2ccc(C(=O)Oc3ccc4c(c3)C(F)(F)c3cc(OC(F)(F)F)ccc3-4)cc2)COC1.CCCCCCCCOc1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.CCCCCc1ccc2c(c1)C(C)c1cc(C#Cc3ccc(OCCCCCCOCC4(CC)COC4)cc3)ccc1-2.CCCCCc1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.CCCc1ccc2c(c1)Cc1cc(C#Cc3ccc(OCCCCCCOCC4(CC)COC4)cc3)ccc1-2.[C-]#[N+]c1ccc2c(c1)C(C)c1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2
InChIInChI=1S/C39H48O3.C37H46O6.C36H42O3.C34H40O5.C31H31NO5.C30H27F5O6/c1-4-6-9-12-32-17-21-35-36-22-18-33(26-38(36)30(3)37(35)25-32)14-13-31-15-19-34(20-16-31)42-24-11-8-7-10-23-40-27-39(5-2)28-41-29-39;1-3-4-5-6-7-8-20-42-32-15-17-34-29(23-32)22-30-24-33(16-18-35(30)34)43-36(38)28-11-13-31(14-12-28)41-21-10-9-19-39-25-37(2)26-40-27-37;1-3-9-29-14-18-34-31(22-29)24-32-23-30(15-19-35(32)34)11-10-28-12-16-33(17-13-28)39-21-8-6-5-7-20-37-25-36(4-2)26-38-27-36;1-3-4-5-8-25-9-15-31-27(19-25)20-28-21-30(14-16-32(28)31)39-33(35)26-10-12-29(13-11-26)38-18-7-6-17-36-22-34(2)23-37-24-34;1-21-28-16-23(32-3)8-12-26(28)27-13-11-25(17-29(21)27)37-30(33)22-6-9-24(10-7-22)36-15-5-4-14-34-18-31(2)19-35-20-31;1-28(17-38-18-28)16-37-12-2-3-13-39-20-6-4-19(5-7-20)27(36)40-21-8-10-23-24-11-9-22(41-30(33,34)35)15-26(24)29(31,32)25(23)14-21/h15-22,25-26,30H,4-12,23-24,27-29H2,1-3H3;11-18,23-24H,3-10,19-22,25-27H2,1-2H3;12-19,22-23H,3-9,20-21,24-27H2,1-2H3;9-16,19,21H,3-8,17-18,20,22-24H2,1-2H3;6-13,16-17,21H,4-5,14-15,18-20H2,1-2H3;4-11,14-15H,2-3,12-13,16-18H2,1H3
InChIKeyGKBOPZHVMXYOQB-UHFFFAOYSA-N
XLogP47.11
TPSA294.16 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds81
Heavy Atoms241
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003279.12
LogP ≤ 547.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate with MolForge

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Related Compounds

(4-isocyanophenyl) 7-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]-9-methyl-9H-fluorene-2-carboxylate;(4-isocyanophenyl) 9-methyl-7-[4-[(1-methylcyclobutyl)methoxy]butoxy]-9H-fluorene-2-carboxylate;[9-methyl-7-[6-[(3-methyloxetan-3-yl)methoxy]hexoxy]-9H-fluoren-2-yl] 4-isocyanobenzoate;(4-octoxyphenyl) 7-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]-9-methyl-9H-fluorene-2-carboxylate;(4-pentylphenyl) 9-methyl-7-[6-[(3-methyloxetan-3-yl)methoxy]hexoxy]-9H-fluorene-2-carboxylate;[4-(trifluoromethoxy)phenyl] 9-methyl-7-[4-[(1-methylcyclobutyl)methoxy]butoxy]-9H-fluorene-2-carboxylate;[4-(trifluoromethoxy)phenyl] 9-methyl-7-[6-[(3-methyloxetan-3-yl)methoxy]hexoxy]-9H-fluorene-2-carboxylate
CID 157294235
[4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]phenyl] 7-isocyano-9-methyl-9H-fluorene-2-carboxylate
CID 58586922
[9-methyl-7-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxy-9H-fluoren-2-yl] 4-nonoxybenzoate
CID 58586889
3-ethyl-3-[6-[[9-methyl-7-[2-(4-octoxyphenyl)ethynyl]-9H-fluoren-2-yl]oxy]hexoxymethyl]oxetane
CID 58586897
[9,9-dimethyl-7-[4-(trifluoromethoxy)benzoyl]oxyfluoren-2-yl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate
CID 58586858
3-ethyl-3-[6-[4-[(7-isocyano-9-methyl-9H-fluoren-2-yl)methoxy]phenoxy]hexoxymethyl]oxetane
CID 58586829
3-[6-[4-[2-[7-[2-(4-isocyanophenyl)ethyl]-9-methyl-9H-fluoren-2-yl]ethyl]phenoxy]hexoxymethyl]-3-methyloxetane
CID 58586815
[4-(trifluoromethoxy)phenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
CID 59767509
[2,4,5-tris[[4-[2-[4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]phenyl]ethynyl]benzoyl]oxy]phenyl] 4-[2-[4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]phenyl]ethynyl]benzoate
CID 58690043
3-ethyl-3-[6-[4-[9-methyl-7-[4-(trifluoromethoxy)phenyl]-9H-fluoren-2-yl]phenoxy]hexoxymethyl]oxetane
CID 71094060
[4-(trifluoromethoxy)phenyl] 4-[8-[(3-methyloxetan-3-yl)methoxy]octoxy]benzoate
CID 59767499
[9-ethyl-7-[[4-(trifluoromethoxy)phenyl]carbamoyl]-9H-fluoren-2-yl] 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate
CID 58586800

Frequently Asked Questions

What is the IUPAC name of [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate?
The IUPAC name of [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate (CID 158279802) is [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate.
What is the SMILES notation for [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate?
The canonical SMILES for [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate is CC1(COCCCCOc2ccc(C(=O)Oc3ccc4c(c3)C(F)(F)c3cc(OC(F)(F)F)ccc3-4)cc2)COC1.CCCCCCCCOc1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.CCCCCc1ccc2c(c1)C(C)c1cc(C#Cc3ccc(OCCCCCCOCC4(CC)COC4)cc3)ccc1-2.CCCCCc1ccc2c(c1)Cc1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.CCCc1ccc2c(c1)Cc1cc(C#Cc3ccc(OCCCCCCOCC4(CC)COC4)cc3)ccc1-2.[C-]#[N+]c1ccc2c(c1)C(C)c1cc(OC(=O)c3ccc(OCCCCOCC4(C)COC4)cc3)ccc1-2.
What is the InChIKey of [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate?
The InChIKey is GKBOPZHVMXYOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H48O3.C37H46O6.C36H42O3.C34H40O5.C31H31NO5.C30H27F5O6/c1-4-6-9-12-32-17-21-35-36-22-18-33(26-38(36)30(3)37(35)25-32)14-13-31-15-19-34(20-16-31)42-24-11-8-7-10-23-40-27-39(5-2)28-41-29-39;1-3-4-5-6-7-8-20-42-32-15-17-34-29(23-32)22-30-24-33(16-18-35(30)34)43-36(38)28-11-13-31(14-12-28)41-21-10-9-19-39-25-37(2)26-40-27-37;1-3-9-29-14-18-34-31(22-29)24-32-23-30(15-19-35(32)34)11-10-28-12-16-33(17-13-28)39-21-8-6-5-7-20-37-25-36(4-2)26-38-27-36;1-3-4-5-8-25-9-15-31-27(19-25)20-28-21-30(14-16-32(28)31)39-33(35)26-10-12-29(13-11-26)38-18-7-6-17-36-22-34(2)23-37-24-34;1-21-28-16-23(32-3)8-12-26(28)27-13-11-25(17-29(21)27)37-30(33)22-6-9-24(10-7-22)36-15-5-4-14-34-18-31(2)19-35-20-31;1-28(17-38-18-28)16-37-12-2-3-13-39-20-6-4-19(5-7-20)27(36)40-21-8-10-23-24-11-9-22(41-30(33,34)35)15-26(24)29(31,32)25(23)14-21/h15-22,25-26,30H,4-12,23-24,27-29H2,1-3H3;11-18,23-24H,3-10,19-22,25-27H2,1-2H3;12-19,22-23H,3-9,20-21,24-27H2,1-2H3;9-16,19,21H,3-8,17-18,20,22-24H2,1-2H3;6-13,16-17,21H,4-5,14-15,18-20H2,1-2H3;4-11,14-15H,2-3,12-13,16-18H2,1H3.
What are the key properties of [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate?
[9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate has a molecular weight of 3279.12 g/mol, XLogP of 47.11, 81 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for [9,9-difluoro-7-(trifluoromethoxy)fluoren-2-yl] 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;3-ethyl-3-[6-[4-[2-(9-methyl-7-pentyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;3-ethyl-3-[6-[4-[2-(7-propyl-9H-fluoren-2-yl)ethynyl]phenoxy]hexoxymethyl]oxetane;(7-isocyano-9-methyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-octoxy-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate;(7-pentyl-9H-fluoren-2-yl) 4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoate is sourced from PubChem (CID 158279802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).