[9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate

C262H326F2O60 — CID 158656976

IUPAC[9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)(C)c3cc(OC(=O)c5ccc(OCOCC6(C)CO6)cc5)ccc3-4)cc2)CO1.CC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)(C)c3cc(OC(=O)c5ccc(OCOCC6(C)COC6)cc5)ccc3-4)cc2)COC1.CC1c2cc(OC(=O)c3ccc(OCOCC4CCC5OC5C4)cc3)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CCC5OC5C4)cc3)cc21.CC1c2cc(OC(=O)c3ccc(OCOCC4CO4)cc3)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CO4)cc3)cc21.CC1c2cc(OC(=O)c3ccc(OCOCC4CO4)cc3F)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CO4)cc3F)cc21.CCC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)c3cc(OC(=O)c5ccc(OCOCC6(CC)COC6)cc5)ccc3-4)cc2)COC1
InChIInChI=1S/C44H44O10.C42H44O10.C41H42O10.C39H38O10.C36H30F2O10.C36H32O10.24CH4/c1-26-37-20-33(51-43(45)29-4-8-31(9-5-29)49-24-47-22-27-2-16-39-41(18-27)53-39)12-14-35(37)36-15-13-34(21-38(26)36)52-44(46)30-6-10-32(11-7-30)50-25-48-23-28-3-17-40-42(19-28)54-40;1-4-41(20-45-21-41)24-47-26-49-31-10-6-29(7-11-31)39(43)51-33-14-16-35-36-17-15-34(19-38(36)28(3)37(35)18-33)52-40(44)30-8-12-32(13-9-30)50-27-48-25-42(5-2)22-46-23-42;1-39(2)35-17-31(50-37(42)27-5-9-29(10-6-27)48-25-46-23-40(3)19-44-20-40)13-15-33(35)34-16-14-32(18-36(34)39)51-38(43)28-7-11-30(12-8-28)49-26-47-24-41(4)21-45-22-41;1-37(2)33-17-29(48-35(40)25-5-9-27(10-6-25)44-23-42-19-38(3)21-46-38)13-15-31(33)32-16-14-30(18-34(32)37)49-36(41)26-7-11-28(12-8-26)45-24-43-20-39(4)22-47-39;1-20-31-10-23(47-35(39)29-8-2-21(12-33(29)37)45-18-41-14-25-16-43-25)4-6-27(31)28-7-5-24(11-32(20)28)48-36(40)30-9-3-22(13-34(30)38)46-19-42-15-26-17-44-26;1-22-33-14-27(45-35(37)23-2-6-25(7-3-23)43-20-39-16-29-18-41-29)10-12-31(33)32-13-11-28(15-34(22)32)46-36(38)24-4-8-26(9-5-24)44-21-40-17-30-19-42-30;;;;;;;;;;;;;;;;;;;;;;;;/h4-15,20-21,26-28,39-42H,2-3,16-19,22-25H2,1H3;6-19,28H,4-5,20-27H2,1-3H3;5-18H,19-26H2,1-4H3;5-18H,19-24H2,1-4H3;2-13,20,25-26H,14-19H2,1H3;2-15,22,29-30H,16-21H2,1H3;24*1H4
InChIKeyICGMALRELGDNLJ-UHFFFAOYSA-N
MW4473.43 g/mol
LogP56.90
Rot. Bonds86

About [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate

[9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate (PubChem CID 158656976) has the molecular formula C262H326F2O60 and a molecular weight of 4473.43 g/mol. Its IUPAC name is [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate.

Molecular Properties

Compound Name[9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate
PubChem CID158656976
Molecular FormulaC262H326F2O60
Molecular Weight4473.43 g/mol
Exact Mass4470.24
IUPAC Name[9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)(C)c3cc(OC(=O)c5ccc(OCOCC6(C)CO6)cc5)ccc3-4)cc2)CO1.CC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)(C)c3cc(OC(=O)c5ccc(OCOCC6(C)COC6)cc5)ccc3-4)cc2)COC1.CC1c2cc(OC(=O)c3ccc(OCOCC4CCC5OC5C4)cc3)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CCC5OC5C4)cc3)cc21.CC1c2cc(OC(=O)c3ccc(OCOCC4CO4)cc3)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CO4)cc3)cc21.CC1c2cc(OC(=O)c3ccc(OCOCC4CO4)cc3F)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CO4)cc3F)cc21.CCC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)c3cc(OC(=O)c5ccc(OCOCC6(CC)COC6)cc5)ccc3-4)cc2)COC1
InChIInChI=1S/C44H44O10.C42H44O10.C41H42O10.C39H38O10.C36H30F2O10.C36H32O10.24CH4/c1-26-37-20-33(51-43(45)29-4-8-31(9-5-29)49-24-47-22-27-2-16-39-41(18-27)53-39)12-14-35(37)36-15-13-34(21-38(26)36)52-44(46)30-6-10-32(11-7-30)50-25-48-23-28-3-17-40-42(19-28)54-40;1-4-41(20-45-21-41)24-47-26-49-31-10-6-29(7-11-31)39(43)51-33-14-16-35-36-17-15-34(19-38(36)28(3)37(35)18-33)52-40(44)30-8-12-32(13-9-30)50-27-48-25-42(5-2)22-46-23-42;1-39(2)35-17-31(50-37(42)27-5-9-29(10-6-27)48-25-46-23-40(3)19-44-20-40)13-15-33(35)34-16-14-32(18-36(34)39)51-38(43)28-7-11-30(12-8-28)49-26-47-24-41(4)21-45-22-41;1-37(2)33-17-29(48-35(40)25-5-9-27(10-6-25)44-23-42-19-38(3)21-46-38)13-15-31(33)32-16-14-30(18-34(32)37)49-36(41)26-7-11-28(12-8-26)45-24-43-20-39(4)22-47-39;1-20-31-10-23(47-35(39)29-8-2-21(12-33(29)37)45-18-41-14-25-16-43-25)4-6-27(31)28-7-5-24(11-32(20)28)48-36(40)30-9-3-22(13-34(30)38)46-19-42-15-26-17-44-26;1-22-33-14-27(45-35(37)23-2-6-25(7-3-23)43-20-39-16-29-18-41-29)10-12-31(33)32-13-11-28(15-34(22)32)46-36(38)24-4-8-26(9-5-24)44-21-40-17-30-19-42-30;;;;;;;;;;;;;;;;;;;;;;;;/h4-15,20-21,26-28,39-42H,2-3,16-19,22-25H2,1H3;6-19,28H,4-5,20-27H2,1-3H3;5-18H,19-26H2,1-4H3;5-18H,19-24H2,1-4H3;2-13,20,25-26H,14-19H2,1H3;2-15,22,29-30H,16-21H2,1H3;24*1H4
InChIKeyICGMALRELGDNLJ-UHFFFAOYSA-N
XLogP56.90
TPSA674.28 Ų
H-Bond Donors
H-Bond Acceptors60
Rotatable Bonds86
Heavy Atoms324
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004473.43
LogP ≤ 556.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1060

Analyze [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate with MolForge

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Related Compounds

[7-[2-fluoro-4-[6-(oxiran-2-ylmethoxy)hexoxy]benzoyl]oxy-9,9-dimethylfluoren-2-yl] 2-fluoro-4-[6-(oxiran-2-ylmethoxy)hexoxy]benzoate
CID 59318879
bis([9,9-dimethyl-7-[4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyfluoren-2-yl] 4-(2-methylprop-2-enoyloxymethoxy)benzoate);[9,9-dimethyl-7-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyfluoren-2-yl] 4-(prop-2-enoyloxymethoxy)benzoate;[7-[2-fluoro-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(2-methylprop-2-enoyloxymethoxy)benzoate;tris([7-[2-fluoro-4-(prop-2-enoyloxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(prop-2-enoyloxymethoxy)benzoate);methane
CID 161384462
[7-[4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoyl]oxy-9,9-dimethylfluoren-2-yl] 4-cyanobenzoate
CID 89267574
[9-methyl-7-[4-[4-[(3-methyloxetan-3-yl)methoxy]butoxy]benzoyl]oxy-9H-fluoren-2-yl] 4-nonoxybenzoate
CID 58586889
[7-[2-fluoro-4-[1-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxy)butoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-[1-[(4-hydroxycyclohexyl)methoxy]butoxy]benzoate
CID 88957940
[9,9-dimethyl-7-[4-(trifluoromethoxy)benzoyl]oxyfluoren-2-yl] 4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]benzoate
CID 58586858
[3-(difluoromethyl)-4-[[4-(oxiran-2-ylmethoxy)phenoxy]methoxy]phenyl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate
CID 21036042
[9,9-dimethyl-7-[4-(trifluoromethoxy)benzoyl]oxyfluoren-2-yl] 4-[4-(oxiran-2-ylmethoxy)butoxy]benzoate
CID 58586871
[7-[2-fluoro-4-(prop-2-enoyloxymethoxy)benzoyl]oxy-9,9-dimethylfluoren-2-yl] 2-fluoro-4-(prop-2-enoyloxymethoxy)benzoate;[4-[4-(2-fluoroprop-2-enoyloxymethoxy)benzoyl]oxy-3-methylphenyl] 4-(2-fluoroprop-2-enoyloxymethoxy)benzoate;methane;[3-methyl-4-[4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-(2-methylprop-2-enoyloxymethoxy)benzoate;[9-methyl-7-[4-(prop-2-enoyloxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(prop-2-enoyloxymethoxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxycarbonyloxy)benzoate
CID 157323542
[9-methyl-7-[[4-[(3-methyloxetan-3-yl)methoxy]phenyl]methylperoxy]-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate
CID 21044879
[4-[6-(oxiran-2-ylmethoxy)hexoxy]phenyl] 4-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxy)butoxy]benzoate
CID 58220436
[3-fluoro-4-[[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)phenoxy]methoxy]phenyl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate
CID 59790588

Frequently Asked Questions

What is the IUPAC name of [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate?
The IUPAC name of [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate (CID 158656976) is [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate.
What is the SMILES notation for [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate?
The canonical SMILES for [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)(C)c3cc(OC(=O)c5ccc(OCOCC6(C)CO6)cc5)ccc3-4)cc2)CO1.CC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)(C)c3cc(OC(=O)c5ccc(OCOCC6(C)COC6)cc5)ccc3-4)cc2)COC1.CC1c2cc(OC(=O)c3ccc(OCOCC4CCC5OC5C4)cc3)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CCC5OC5C4)cc3)cc21.CC1c2cc(OC(=O)c3ccc(OCOCC4CO4)cc3)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CO4)cc3)cc21.CC1c2cc(OC(=O)c3ccc(OCOCC4CO4)cc3F)ccc2-c2ccc(OC(=O)c3ccc(OCOCC4CO4)cc3F)cc21.CCC1(COCOc2ccc(C(=O)Oc3ccc4c(c3)C(C)c3cc(OC(=O)c5ccc(OCOCC6(CC)COC6)cc5)ccc3-4)cc2)COC1.
What is the InChIKey of [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate?
The InChIKey is ICGMALRELGDNLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H44O10.C42H44O10.C41H42O10.C39H38O10.C36H30F2O10.C36H32O10.24CH4/c1-26-37-20-33(51-43(45)29-4-8-31(9-5-29)49-24-47-22-27-2-16-39-41(18-27)53-39)12-14-35(37)36-15-13-34(21-38(26)36)52-44(46)30-6-10-32(11-7-30)50-25-48-23-28-3-17-40-42(19-28)54-40;1-4-41(20-45-21-41)24-47-26-49-31-10-6-29(7-11-31)39(43)51-33-14-16-35-36-17-15-34(19-38(36)28(3)37(35)18-33)52-40(44)30-8-12-32(13-9-30)50-27-48-25-42(5-2)22-46-23-42;1-39(2)35-17-31(50-37(42)27-5-9-29(10-6-27)48-25-46-23-40(3)19-44-20-40)13-15-33(35)34-16-14-32(18-36(34)39)51-38(43)28-7-11-30(12-8-28)49-26-47-24-41(4)21-45-22-41;1-37(2)33-17-29(48-35(40)25-5-9-27(10-6-25)44-23-42-19-38(3)21-46-38)13-15-31(33)32-16-14-30(18-34(32)37)49-36(41)26-7-11-28(12-8-26)45-24-43-20-39(4)22-47-39;1-20-31-10-23(47-35(39)29-8-2-21(12-33(29)37)45-18-41-14-25-16-43-25)4-6-27(31)28-7-5-24(11-32(20)28)48-36(40)30-9-3-22(13-34(30)38)46-19-42-15-26-17-44-26;1-22-33-14-27(45-35(37)23-2-6-25(7-3-23)43-20-39-16-29-18-41-29)10-12-31(33)32-13-11-28(15-34(22)32)46-36(38)24-4-8-26(9-5-24)44-21-40-17-30-19-42-30;;;;;;;;;;;;;;;;;;;;;;;;/h4-15,20-21,26-28,39-42H,2-3,16-19,22-25H2,1H3;6-19,28H,4-5,20-27H2,1-3H3;5-18H,19-26H2,1-4H3;5-18H,19-24H2,1-4H3;2-13,20,25-26H,14-19H2,1H3;2-15,22,29-30H,16-21H2,1H3;24*1H4.
What are the key properties of [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate?
[9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate has a molecular weight of 4473.43 g/mol, XLogP of 56.90, 86 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for [9,9-dimethyl-7-[4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(3-methyloxetan-3-yl)methoxymethoxy]benzoate;[9,9-dimethyl-7-[4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoyl]oxyfluoren-2-yl] 4-[(2-methyloxiran-2-yl)methoxymethoxy]benzoate;[7-[4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 4-[(3-ethyloxetan-3-yl)methoxymethoxy]benzoate;[7-[2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9-methyl-9H-fluoren-2-yl] 2-fluoro-4-(oxiran-2-ylmethoxymethoxy)benzoate;methane;[9-methyl-7-[4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(7-oxabicyclo[4.1.0]heptan-3-ylmethoxymethoxy)benzoate;[9-methyl-7-[4-(oxiran-2-ylmethoxymethoxy)benzoyl]oxy-9H-fluoren-2-yl] 4-(oxiran-2-ylmethoxymethoxy)benzoate is sourced from PubChem (CID 158656976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).