bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate

C268H332O60 — CID 158951272

IUPACbis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate
SMILESCCCCCC(=O)Oc1ccc(C(=O)OC2CCC(OC(=O)c3ccc(OC(=O)CCCCC)cc3)CC2)cc1.CCCCCCCC(=O)Oc1ccc(C(=O)OC2CCC(OC(=O)c3ccc(OC(=O)CCCCCCC)cc3)CC2)cc1.CCCCCCCOC(=O)c1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(C(=O)OCCCCCCC)cc3)CC2)cc1.CCCCCCCOC(=O)c1ccc(OC(=O)C=CC(=O)Oc2ccc(C(=O)OCCCCCCC)cc2)cc1.CCCCCCCc1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(CCCCCCC)cc3)CC2)cc1.CCCCCCCc1ccc(OC(=O)C=CC(=O)Oc2ccc(CCCCCCC)cc2)cc1.CCCCCCOc1ccc(OC(=O)C=CC(=O)Oc2ccc(OCCCCCC)cc2)cc1.CCOC(=O)c1ccc(OC(=O)C#CC(=O)Oc2ccc(C(=O)OCC)cc2)cc1.COc1ccc(OC(=O)C#CC(=O)Oc2ccc(OC)cc2)cc1
InChIInChI=1S/2C36H48O8.C34H48O4.2C32H40O8.C30H40O4.C28H36O6.C22H18O8.C18H14O6/c1-3-5-7-9-11-25-41-33(37)27-17-21-31(22-18-27)43-35(39)29-13-15-30(16-14-29)36(40)44-32-23-19-28(20-24-32)34(38)42-26-12-10-8-6-4-2;1-3-5-7-9-11-13-33(37)41-29-19-15-27(16-20-29)35(39)43-31-23-25-32(26-24-31)44-36(40)28-17-21-30(22-18-28)42-34(38)14-12-10-8-6-4-2;1-3-5-7-9-11-13-27-15-23-31(24-16-27)37-33(35)29-19-21-30(22-20-29)34(36)38-32-25-17-28(18-26-32)14-12-10-8-6-4-2;1-3-5-7-9-29(33)37-25-15-11-23(12-16-25)31(35)39-27-19-21-28(22-20-27)40-32(36)24-13-17-26(18-14-24)38-30(34)10-8-6-4-2;1-3-5-7-9-11-23-37-31(35)25-13-17-27(18-14-25)39-29(33)21-22-30(34)40-28-19-15-26(16-20-28)32(36)38-24-12-10-8-6-4-2;1-3-5-7-9-11-13-25-15-19-27(20-16-25)33-29(31)23-24-30(32)34-28-21-17-26(18-22-28)14-12-10-8-6-4-2;1-3-5-7-9-21-31-23-11-15-25(16-12-23)33-27(29)19-20-28(30)34-26-17-13-24(14-18-26)32-22-10-8-6-4-2;1-3-27-21(25)15-5-9-17(10-6-15)29-19(23)13-14-20(24)30-18-11-7-16(8-12-18)22(26)28-4-2;1-21-13-3-7-15(8-4-13)23-17(19)11-12-18(20)24-16-9-5-14(22-2)6-10-16/h17-24,29-30H,3-16,25-26H2,1-2H3;15-22,31-32H,3-14,23-26H2,1-2H3;15-18,23-26,29-30H,3-14,19-22H2,1-2H3;11-18,27-28H,3-10,19-22H2,1-2H3;13-22H,3-12,23-24H2,1-2H3;15-24H,3-14H2,1-2H3;11-20H,3-10,21-22H2,1-2H3;5-12H,3-4H2,1-2H3;3-10H,1-2H3
InChIKeyJLLMQAJKYPTXKM-UHFFFAOYSA-N
MW4513.54 g/mol
LogP59.05
Rot. Bonds126

About bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate

bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate (PubChem CID 158951272) has the molecular formula C268H332O60 and a molecular weight of 4513.54 g/mol. Its IUPAC name is bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate.

Molecular Properties

Compound Namebis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate
PubChem CID158951272
Molecular FormulaC268H332O60
Molecular Weight4513.54 g/mol
Exact Mass4510.29
IUPAC Namebis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate
SMILESCCCCCC(=O)Oc1ccc(C(=O)OC2CCC(OC(=O)c3ccc(OC(=O)CCCCC)cc3)CC2)cc1.CCCCCCCC(=O)Oc1ccc(C(=O)OC2CCC(OC(=O)c3ccc(OC(=O)CCCCCCC)cc3)CC2)cc1.CCCCCCCOC(=O)c1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(C(=O)OCCCCCCC)cc3)CC2)cc1.CCCCCCCOC(=O)c1ccc(OC(=O)C=CC(=O)Oc2ccc(C(=O)OCCCCCCC)cc2)cc1.CCCCCCCc1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(CCCCCCC)cc3)CC2)cc1.CCCCCCCc1ccc(OC(=O)C=CC(=O)Oc2ccc(CCCCCCC)cc2)cc1.CCCCCCOc1ccc(OC(=O)C=CC(=O)Oc2ccc(OCCCCCC)cc2)cc1.CCOC(=O)c1ccc(OC(=O)C#CC(=O)Oc2ccc(C(=O)OCC)cc2)cc1.COc1ccc(OC(=O)C#CC(=O)Oc2ccc(OC)cc2)cc1
InChIInChI=1S/2C36H48O8.C34H48O4.2C32H40O8.C30H40O4.C28H36O6.C22H18O8.C18H14O6/c1-3-5-7-9-11-25-41-33(37)27-17-21-31(22-18-27)43-35(39)29-13-15-30(16-14-29)36(40)44-32-23-19-28(20-24-32)34(38)42-26-12-10-8-6-4-2;1-3-5-7-9-11-13-33(37)41-29-19-15-27(16-20-29)35(39)43-31-23-25-32(26-24-31)44-36(40)28-17-21-30(22-18-28)42-34(38)14-12-10-8-6-4-2;1-3-5-7-9-11-13-27-15-23-31(24-16-27)37-33(35)29-19-21-30(22-20-29)34(36)38-32-25-17-28(18-26-32)14-12-10-8-6-4-2;1-3-5-7-9-29(33)37-25-15-11-23(12-16-25)31(35)39-27-19-21-28(22-20-27)40-32(36)24-13-17-26(18-14-24)38-30(34)10-8-6-4-2;1-3-5-7-9-11-23-37-31(35)25-13-17-27(18-14-25)39-29(33)21-22-30(34)40-28-19-15-26(16-20-28)32(36)38-24-12-10-8-6-4-2;1-3-5-7-9-11-13-25-15-19-27(20-16-25)33-29(31)23-24-30(32)34-28-21-17-26(18-22-28)14-12-10-8-6-4-2;1-3-5-7-9-21-31-23-11-15-25(16-12-23)33-27(29)19-20-28(30)34-26-17-13-24(14-18-26)32-22-10-8-6-4-2;1-3-27-21(25)15-5-9-17(10-6-15)29-19(23)13-14-20(24)30-18-11-7-16(8-12-18)22(26)28-4-2;1-21-13-3-7-15(8-4-13)23-17(19)11-12-18(20)24-16-9-5-14(22-2)6-10-16/h17-24,29-30H,3-16,25-26H2,1-2H3;15-22,31-32H,3-14,23-26H2,1-2H3;15-18,23-26,29-30H,3-14,19-22H2,1-2H3;11-18,27-28H,3-10,19-22H2,1-2H3;13-22H,3-12,23-24H2,1-2H3;15-24H,3-14H2,1-2H3;11-20H,3-10,21-22H2,1-2H3;5-12H,3-4H2,1-2H3;3-10H,1-2H3
InChIKeyJLLMQAJKYPTXKM-UHFFFAOYSA-N
XLogP59.05
TPSA773.32 Ų
H-Bond Donors
H-Bond Acceptors60
Rotatable Bonds126
Heavy Atoms328
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004513.54
LogP ≤ 559.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1060

Analyze bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate with MolForge

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Related Compounds

bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-ethylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;bis(bis(4-methylphenyl) but-2-ynedioate);diphenyl but-2-ynedioate;[4-(4-ethylbenzoyl)oxycyclohexyl] 4-ethylbenzoate;bis([4-(4-methoxybenzoyl)oxycyclohexyl] 4-methoxybenzoate);bis([4-(4-methylbenzoyl)oxycyclohexyl] 4-methylbenzoate)
CID 159211886
[4-(4-hexylphenoxy)carbonylcyclohexyl] 4-(6-prop-2-enoyloxyhexyl)benzoate
CID 118528796
bis(4-ethoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis[4-(2-hydroxyethoxy)phenyl] cyclohexane-1,4-dicarboxylate;bis(4-methoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-octylphenyl) cyclohexane-1,4-dicarboxylate
CID 158933803
10-[4-[4-[3-[4-[11-(4-ethenylphenoxy)-11-oxoundecoxy]phenyl]prop-2-ynoyloxy]phenoxy]carbonylcyclohexyl]oxydecyl 4-ethenylbenzoate
CID 139527186
[4-(4-propylphenoxy)carbonylcyclohexyl] 4-propylbenzoate
CID 21053167
bis(4-ethylphenyl) benzene-1,4-dicarboxylate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptylphenyl) but-2-enedioate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methylphenyl) benzene-1,4-dicarboxylate;(4-cyanophenyl) 4-(hydroxymethyl)benzoate;tris((4-cyanophenyl) 4-methylbenzoate);4-O-(4-heptylphenyl) 1-O-(4-methylphenyl) benzene-1,4-dicarboxylate;(4-isocyanophenyl) 4-[4-(4-cyanophenyl)-4-oxobutanoyl]oxybenzoate;(4-methoxyphenyl) 4-methylbenzoate;(4-methylphenyl) 4-isocyanobenzoate
CID 162088747
1-O-(4-hexylphenyl) 4-O-[4-(6-prop-2-enoyloxyhexyl)phenyl] cyclohexane-1,4-dicarboxylate
CID 59386500
bis(4-heptoxycarbonylphenyl) (Z)-but-2-enedioate;1-O-[4-(4-cyanobenzoyl)phenyl] 4-O-[4-(4-isocyanophenoxy)carbonylphenyl] butanedioate;(4-cyanophenyl) 4-methoxybenzoate;bis((4-cyanophenyl) 4-methylbenzoate);(4-ethylphenyl) 4-(4-ethylbenzoyl)benzoate;(4-isocyanophenyl)-(4-methylphenyl)methanone;(4-methoxyphenyl) 4-methylbenzoate;4-(4-methylbenzoyl)benzonitrile;(4-methylphenyl) 4-(4-heptylbenzoyl)benzoate
CID 159364639
7-[4-[4-(4-nonylphenoxy)carbonylphenoxy]carbonylphenoxy]heptyl 4-(4-heptylphenyl)benzoate
CID 102091630
(4-methoxyphenyl) 4-(6-propanoyloxyhexyl)benzoate
CID 101128329
6-O-(4-methoxyphenyl) 1-O-octyl hexanedioate
CID 91712340
octyl 4-(4-pentylcyclohexanecarbonyl)oxybenzoate
CID 139725405

Frequently Asked Questions

What is the IUPAC name of bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate?
The IUPAC name of bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate (CID 158951272) is bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate.
What is the SMILES notation for bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate?
The canonical SMILES for bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate is CCCCCC(=O)Oc1ccc(C(=O)OC2CCC(OC(=O)c3ccc(OC(=O)CCCCC)cc3)CC2)cc1.CCCCCCCC(=O)Oc1ccc(C(=O)OC2CCC(OC(=O)c3ccc(OC(=O)CCCCCCC)cc3)CC2)cc1.CCCCCCCOC(=O)c1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(C(=O)OCCCCCCC)cc3)CC2)cc1.CCCCCCCOC(=O)c1ccc(OC(=O)C=CC(=O)Oc2ccc(C(=O)OCCCCCCC)cc2)cc1.CCCCCCCc1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(CCCCCCC)cc3)CC2)cc1.CCCCCCCc1ccc(OC(=O)C=CC(=O)Oc2ccc(CCCCCCC)cc2)cc1.CCCCCCOc1ccc(OC(=O)C=CC(=O)Oc2ccc(OCCCCCC)cc2)cc1.CCOC(=O)c1ccc(OC(=O)C#CC(=O)Oc2ccc(C(=O)OCC)cc2)cc1.COc1ccc(OC(=O)C#CC(=O)Oc2ccc(OC)cc2)cc1.
What is the InChIKey of bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate?
The InChIKey is JLLMQAJKYPTXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C36H48O8.C34H48O4.2C32H40O8.C30H40O4.C28H36O6.C22H18O8.C18H14O6/c1-3-5-7-9-11-25-41-33(37)27-17-21-31(22-18-27)43-35(39)29-13-15-30(16-14-29)36(40)44-32-23-19-28(20-24-32)34(38)42-26-12-10-8-6-4-2;1-3-5-7-9-11-13-33(37)41-29-19-15-27(16-20-29)35(39)43-31-23-25-32(26-24-31)44-36(40)28-17-21-30(22-18-28)42-34(38)14-12-10-8-6-4-2;1-3-5-7-9-11-13-27-15-23-31(24-16-27)37-33(35)29-19-21-30(22-20-29)34(36)38-32-25-17-28(18-26-32)14-12-10-8-6-4-2;1-3-5-7-9-29(33)37-25-15-11-23(12-16-25)31(35)39-27-19-21-28(22-20-27)40-32(36)24-13-17-26(18-14-24)38-30(34)10-8-6-4-2;1-3-5-7-9-11-23-37-31(35)25-13-17-27(18-14-25)39-29(33)21-22-30(34)40-28-19-15-26(16-20-28)32(36)38-24-12-10-8-6-4-2;1-3-5-7-9-11-13-25-15-19-27(20-16-25)33-29(31)23-24-30(32)34-28-21-17-26(18-22-28)14-12-10-8-6-4-2;1-3-5-7-9-21-31-23-11-15-25(16-12-23)33-27(29)19-20-28(30)34-26-17-13-24(14-18-26)32-22-10-8-6-4-2;1-3-27-21(25)15-5-9-17(10-6-15)29-19(23)13-14-20(24)30-18-11-7-16(8-12-18)22(26)28-4-2;1-21-13-3-7-15(8-4-13)23-17(19)11-12-18(20)24-16-9-5-14(22-2)6-10-16/h17-24,29-30H,3-16,25-26H2,1-2H3;15-22,31-32H,3-14,23-26H2,1-2H3;15-18,23-26,29-30H,3-14,19-22H2,1-2H3;11-18,27-28H,3-10,19-22H2,1-2H3;13-22H,3-12,23-24H2,1-2H3;15-24H,3-14H2,1-2H3;11-20H,3-10,21-22H2,1-2H3;5-12H,3-4H2,1-2H3;3-10H,1-2H3.
What are the key properties of bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate?
bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate has a molecular weight of 4513.54 g/mol, XLogP of 59.05, 126 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-ethoxycarbonylphenyl) but-2-ynedioate;bis(4-heptoxycarbonylphenyl) but-2-enedioate;bis(4-heptoxycarbonylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-heptylphenyl) but-2-enedioate;bis(4-heptylphenyl) cyclohexane-1,4-dicarboxylate;bis(4-hexoxyphenyl) but-2-enedioate;bis(4-methoxyphenyl) but-2-ynedioate;[4-(4-hexanoyloxybenzoyl)oxycyclohexyl] 4-hexanoyloxybenzoate;[4-(4-octanoyloxybenzoyl)oxycyclohexyl] 4-octanoyloxybenzoate is sourced from PubChem (CID 158951272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).