[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate

C152H159F3O52 — CID 159607421

IUPAC[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate
SMILESC=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)c(C)c2C)CC1.C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)cc2)CC1.C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)cc2C)CC1.C=CC(=O)OCOOC(=O)Oc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OC(=O)OCOC(=O)C=C)cc3)c(C)c2)cc1.C=CC(=O)OCOc1ccc(/C=C/C(=O)Oc2ccc(OC(=O)/C=C/c3ccc(OCOC(=O)C=C)cc3)c(C(F)(F)F)c2C)cc1
InChIInChI=1S/C34H27F3O10.C31H24O15.C30H38O9.C29H36O9.C28H34O9/c1-4-29(38)44-20-42-25-12-6-23(7-13-25)10-18-31(40)46-27-16-17-28(33(22(27)3)34(35,36)37)47-32(41)19-11-24-8-14-26(15-9-24)43-21-45-30(39)5-2;1-4-26(32)38-17-40-30(36)43-22-10-8-21(9-11-22)29(35)45-25-15-14-24(16-19(25)3)42-28(34)20-6-12-23(13-7-20)44-31(37)46-41-18-39-27(33)5-2;1-5-27(31)35-17-21-7-9-22(10-8-21)29(33)38-25-15-16-26(20(4)19(25)3)39-30(34)23-11-13-24(14-12-23)36-18-37-28(32)6-2;1-4-26(30)34-17-20-6-8-21(9-7-20)28(32)37-24-14-15-25(19(3)16-24)38-29(33)22-10-12-23(13-11-22)35-18-36-27(31)5-2;1-3-25(29)33-17-19-5-7-20(8-6-19)27(31)36-23-13-15-24(16-14-23)37-28(32)21-9-11-22(12-10-21)34-18-35-26(30)4-2/h4-19H,1-2,20-21H2,3H3;4-16H,1-2,17-18H2,3H3;5-6,15-16,21-24H,1-2,7-14,17-18H2,3-4H3;4-5,14-16,20-23H,1-2,6-13,17-18H2,3H3;3-4,13-16,19-22H,1-2,5-12,17-18H2/b18-10+,19-11+;;;;
InChIKeyMMGICPMGKAPQGN-MVNVFJBHSA-N
MW2874.89 g/mol
LogP24.96
Rot. Bonds60

About [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate

[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate (PubChem CID 159607421) has the molecular formula C152H159F3O52 and a molecular weight of 2874.89 g/mol. Its IUPAC name is [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate.

Molecular Properties

Compound Name[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate
PubChem CID159607421
Molecular FormulaC152H159F3O52
Molecular Weight2874.89 g/mol
Exact Mass2872.97
IUPAC Name[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate
SMILESC=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)c(C)c2C)CC1.C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)cc2)CC1.C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)cc2C)CC1.C=CC(=O)OCOOC(=O)Oc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OC(=O)OCOC(=O)C=C)cc3)c(C)c2)cc1.C=CC(=O)OCOc1ccc(/C=C/C(=O)Oc2ccc(OC(=O)/C=C/c3ccc(OCOC(=O)C=C)cc3)c(C(F)(F)F)c2C)cc1
InChIInChI=1S/C34H27F3O10.C31H24O15.C30H38O9.C29H36O9.C28H34O9/c1-4-29(38)44-20-42-25-12-6-23(7-13-25)10-18-31(40)46-27-16-17-28(33(22(27)3)34(35,36)37)47-32(41)19-11-24-8-14-26(15-9-24)43-21-45-30(39)5-2;1-4-26(32)38-17-40-30(36)43-22-10-8-21(9-11-22)29(35)45-25-15-14-24(16-19(25)3)42-28(34)20-6-12-23(13-7-20)44-31(37)46-41-18-39-27(33)5-2;1-5-27(31)35-17-21-7-9-22(10-8-21)29(33)38-25-15-16-26(20(4)19(25)3)39-30(34)23-11-13-24(14-12-23)36-18-37-28(32)6-2;1-4-26(30)34-17-20-6-8-21(9-7-20)28(32)37-24-14-15-25(19(3)16-24)38-29(33)22-10-12-23(13-11-22)35-18-36-27(31)5-2;1-3-25(29)33-17-19-5-7-20(8-6-19)27(31)36-23-13-15-24(16-14-23)37-28(32)21-9-11-22(12-10-21)34-18-35-26(30)4-2/h4-19H,1-2,20-21H2,3H3;4-16H,1-2,17-18H2,3H3;5-6,15-16,21-24H,1-2,7-14,17-18H2,3-4H3;4-5,14-16,20-23H,1-2,6-13,17-18H2,3H3;3-4,13-16,19-22H,1-2,5-12,17-18H2/b18-10+,19-11+;;;;
InChIKeyMMGICPMGKAPQGN-MVNVFJBHSA-N
XLogP24.96
TPSA652.44 Ų
H-Bond Donors
H-Bond Acceptors52
Rotatable Bonds60
Heavy Atoms207
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002874.89
LogP ≤ 524.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1052

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate with MolForge

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Related Compounds

methane;[4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxy-2,3-bis(trifluoromethyl)phenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-2,3-bis(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate
CID 161423454
[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[2,3-dimethyl-4-[3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl] 3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[3-methyl-4-[3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl] 3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoate;[3-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxyphenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[4-[3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl] 3-[4-(prop-2-enoyloxymethoxy)phenyl]propanoate;[4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxyphenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate
CID 161104418
bis[4-(6-prop-2-enoyloxyhexoxy)phenyl] cyclohexane-1,4-dicarboxylate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-[4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoate;[3-methyl-4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate;[3-methyl-4-[4-(3-prop-2-enoyloxypropoxy)benzoyl]oxyphenyl] 4-(3-prop-2-enoyloxypropoxy)benzoate
CID 158233395
[3-tert-butyl-4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;hexyl 2,5-bis[[4-(prop-2-enoyloxymethoxy)benzoyl]oxy]benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethoxycarbonyloxy)benzoate;[3-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxyphenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;pentyl 2,5-bis[[4-(prop-2-enoyloxymethoxy)benzoyl]oxy]benzoate
CID 161219722
[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate
CID 89116660
[9-ethyl-7-[[4-(prop-2-enoyloxymethoxy)phenoxy]methoxy]-9H-fluoren-2-yl] 4-(prop-2-enoyloxymethoxy)benzoate;methane;bis([9-methyl-7-[[4-(prop-2-enoyloxymethoxy)phenoxy]methoxy]-9H-fluoren-2-yl] 4-(prop-2-enoyloxymethoxy)benzoate);bis([9-methyl-7-[[4-(prop-2-enoyloxymethyl)cyclohexyl]oxymethoxy]-9H-fluoren-2-yl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate)
CID 160762994
[4-(4-ethylcyclohexyl)phenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[4-(4-ethyl-2-methylphenoxy)carbonylphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;(4-ethyl-2-methylphenyl) 6-[4-(prop-2-enoyloxymethoxy)benzoyl]oxynaphthalene-2-carboxylate;[4-[(E)-2-(4-ethylphenyl)ethenyl]phenyl] 4-(prop-2-enoyloxymethoxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-ethylbenzoate;[4-[4-(prop-2-enoyloxymethoxy)benzoyl]oxyphenyl] 4-ethylbenzoate
CID 162006073
[4-[(4-ethenylphenoxy)methoxy]-3-methylphenyl] 4-ethenylbenzoate;[6-[(4-ethenylphenoxy)methoxy]naphthalen-2-yl] 4-(prop-2-enoyloxymethoxy)benzoate;[4-[(4-ethenylphenoxy)methoxy]phenyl] 4-ethenylbenzoate
CID 158374847
[3-methyl-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[3-methyl-4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate;[4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate;[4-[4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoyl]oxyphenyl] 4-(4-prop-2-enoyloxybutoxycarbonyloxy)benzoate;[4-[4-(6-prop-2-enoyloxyhexoxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate
CID 162149365
bis(bis[4-(prop-2-enoyloxymethyl)phenyl] cyclohexane-1,4-dicarboxylate);ethane;[4-(4-hexoxycyclohexanecarbonyl)oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate;bis(1-O-(4-hexylphenyl) 4-O-[4-(prop-2-enoyloxymethyl)phenyl] cyclohexane-1,4-dicarboxylate);bis([4-(4-pentylcyclohexanecarbonyl)oxyphenyl] 4-(prop-2-enoyloxymethoxy)benzoate);[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-hexoxybenzoate
CID 161042162
[3-methyl-4-[4-[4-(5-prop-2-enoyloxypentoxycarbonyloxy)benzoyl]oxybenzoyl]oxyphenyl] 4-[4-(5-prop-2-enoyloxypentoxycarbonyloxy)benzoyl]oxybenzoate
CID 59847611
[3-methyl-4-[4-(6-prop-2-enoyloxyhexoxycarbonyloxy)benzoyl]oxyphenyl] 4-(6-prop-2-enoyloxyhexoxycarbonyloxy)benzoate
CID 58721045

Frequently Asked Questions

What is the IUPAC name of [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate?
The IUPAC name of [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate (CID 159607421) is [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate.
What is the SMILES notation for [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate?
The canonical SMILES for [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate is C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)c(C)c2C)CC1.C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)cc2)CC1.C=CC(=O)OCOC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(COC(=O)C=C)CC3)cc2C)CC1.C=CC(=O)OCOOC(=O)Oc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OC(=O)OCOC(=O)C=C)cc3)c(C)c2)cc1.C=CC(=O)OCOc1ccc(/C=C/C(=O)Oc2ccc(OC(=O)/C=C/c3ccc(OCOC(=O)C=C)cc3)c(C(F)(F)F)c2C)cc1.
What is the InChIKey of [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate?
The InChIKey is MMGICPMGKAPQGN-MVNVFJBHSA-N. The full InChI is InChI=1S/C34H27F3O10.C31H24O15.C30H38O9.C29H36O9.C28H34O9/c1-4-29(38)44-20-42-25-12-6-23(7-13-25)10-18-31(40)46-27-16-17-28(33(22(27)3)34(35,36)37)47-32(41)19-11-24-8-14-26(15-9-24)43-21-45-30(39)5-2;1-4-26(32)38-17-40-30(36)43-22-10-8-21(9-11-22)29(35)45-25-15-14-24(16-19(25)3)42-28(34)20-6-12-23(13-7-20)44-31(37)46-41-18-39-27(33)5-2;1-5-27(31)35-17-21-7-9-22(10-8-21)29(33)38-25-15-16-26(20(4)19(25)3)39-30(34)23-11-13-24(14-12-23)36-18-37-28(32)6-2;1-4-26(30)34-17-20-6-8-21(9-7-20)28(32)37-24-14-15-25(19(3)16-24)38-29(33)22-10-12-23(13-11-22)35-18-36-27(31)5-2;1-3-25(29)33-17-19-5-7-20(8-6-19)27(31)36-23-13-15-24(16-14-23)37-28(32)21-9-11-22(12-10-21)34-18-35-26(30)4-2/h4-19H,1-2,20-21H2,3H3;4-16H,1-2,17-18H2,3H3;5-6,15-16,21-24H,1-2,7-14,17-18H2,3-4H3;4-5,14-16,20-23H,1-2,6-13,17-18H2,3H3;3-4,13-16,19-22H,1-2,5-12,17-18H2/b18-10+,19-11+;;;;.
What are the key properties of [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate?
[2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate has a molecular weight of 2874.89 g/mol, XLogP of 24.96, 60 rotatable bonds, 0 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dimethyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[3-methyl-4-[4-(prop-2-enoyloxymethoxycarbonyloxy)benzoyl]oxyphenyl] 4-(prop-2-enoyloxymethylperoxycarbonyloxy)benzoate;[3-methyl-4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate;[2-methyl-4-[(E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoyl]oxy-3-(trifluoromethyl)phenyl] (E)-3-[4-(prop-2-enoyloxymethoxy)phenyl]prop-2-enoate;[4-[4-(prop-2-enoyloxymethoxy)cyclohexanecarbonyl]oxyphenyl] 4-(prop-2-enoyloxymethyl)cyclohexane-1-carboxylate is sourced from PubChem (CID 159607421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).