[4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate

C₃₂₂H₃₇₀F₂₈O₇₆S₃ — CID 159990972

About [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate

[4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate (PubChem CID 159990972) has the molecular formula C₃₂₂H₃₇₀F₂₈O₇₆S₃ and a molecular weight of 6084.57 g/mol. Its IUPAC name is [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate.

Molecular Properties

• Compound Name: [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate
• PubChem CID: 159990972
• Molecular Formula: C₃₂₂H₃₇₀F₂₈O₇₆S₃
• Molecular Weight: 6084.57 g/mol
• Exact Mass: 6080.38
• IUPAC Name: [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C=C(C)C(=O)OCOc1ccc(C(=O)Oc2c(F)cc(C(c3cc(F)c(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4C)c(F)c3)(C(F)(F)F)C(F)(F)F)cc2F)c(C)c1.C=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc(C(c3ccc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(C=CC(=O)Oc2ccc(C(c3ccc(OC(=O)C=Cc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(C=CC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)C=Cc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(CCC(=O)Oc2ccc(C(c3ccc(OC(=O)CCc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(CCC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)CCc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)c(C)c1
• InChI: InChI=1S/C45H42F6O10.C45H38F6O10.C42H42O12S.C42H38O12S.C41H30F10O10.C41H34F6O10.C38H34O12S.28CH4/c2*1-27(2)41(54)58-25-56-37-15-7-31(29(5)23-37)9-21-39(52)60-35-17-11-33(12-18-35)43(44(46,47)48,45(49,50)51)34-13-19-36(20-14-34)61-40(53)22-10-32-8-16-38(24-30(32)6)57-26-59-42(55)28(3)4;2*1-27(2)41(45)51-25-49-35-11-7-31(29(5)23-35)9-21-39(43)53-33-13-17-37(18-14-33)55(47,48)38-19-15-34(16-20-38)54-40(44)22-10-32-8-12-36(24-30(32)6)50-26-52-42(46)28(3)4;1-19(2)35(52)58-17-56-25-7-9-27(21(5)11-25)37(54)60-33-29(42)13-23(14-30(33)43)39(40(46,47)48,41(49,50)51)24-15-31(44)34(32(45)16-24)61-38(55)28-10-8-26(12-22(28)6)57-18-59-36(53)20(3)4;1-23(2)35(48)54-21-52-31-15-17-33(25(5)19-31)37(50)56-29-11-7-27(8-12-29)39(40(42,43)44,41(45,46)47)28-9-13-30(14-10-28)57-38(51)34-18-16-32(20-26(34)6)53-22-55-36(49)24(3)4;1-23(2)35(39)47-21-45-29-11-17-33(25(5)19-29)37(41)49-27-7-13-31(14-8-27)51(43,44)32-15-9-28(10-16-32)50-38(42)34-18-12-30(20-26(34)6)46-22-48-36(40)24(3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h7-8,11-20,23-24H,1,3,9-10,21-22,25-26H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-8,11-20,23-24H,1,3,9-10,21-22,25-26H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-16H,1,3,17-18H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;28*1H4
• InChIKey: OGYCDTJXIKTZDA-UHFFFAOYSA-N
• XLogP: 76.95
• TPSA: 968.04 Ų
• H-Bond Acceptors: 76
• Rotatable Bonds: 110
• Heavy Atoms: 429
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	6084.57
LogP ≤ 5	76.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	76

Frequently Asked Questions

What is the IUPAC name of [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate?

The IUPAC name of [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate (CID 159990972) is [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate.

What is the SMILES notation for [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate?

The canonical SMILES for [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)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.C.C.C.C.C=C(C)C(=O)OCOc1ccc(C(=O)Oc2c(F)cc(C(c3cc(F)c(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4C)c(F)c3)(C(F)(F)F)C(F)(F)F)cc2F)c(C)c1.C=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc(C(c3ccc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(C=CC(=O)Oc2ccc(C(c3ccc(OC(=O)C=Cc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(C=CC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)C=Cc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(CCC(=O)Oc2ccc(C(c3ccc(OC(=O)CCc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1.C=C(C)C(=O)OCOc1ccc(CCC(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)CCc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)c(C)c1.

What is the InChIKey of [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate?

The InChIKey is OGYCDTJXIKTZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H42F6O10.C45H38F6O10.C42H42O12S.C42H38O12S.C41H30F10O10.C41H34F6O10.C38H34O12S.28CH4/c2*1-27(2)41(54)58-25-56-37-15-7-31(29(5)23-37)9-21-39(52)60-35-17-11-33(12-18-35)43(44(46,47)48,45(49,50)51)34-13-19-36(20-14-34)61-40(53)22-10-32-8-16-38(24-30(32)6)57-26-59-42(55)28(3)4;2*1-27(2)41(45)51-25-49-35-11-7-31(29(5)23-35)9-21-39(43)53-33-13-17-37(18-14-33)55(47,48)38-19-15-34(16-20-38)54-40(44)22-10-32-8-12-36(24-30(32)6)50-26-52-42(46)28(3)4;1-19(2)35(52)58-17-56-25-7-9-27(21(5)11-25)37(54)60-33-29(42)13-23(14-30(33)43)39(40(46,47)48,41(49,50)51)24-15-31(44)34(32(45)16-24)61-38(55)28-10-8-26(12-22(28)6)57-18-59-36(53)20(3)4;1-23(2)35(48)54-21-52-31-15-17-33(25(5)19-31)37(50)56-29-11-7-27(8-12-29)39(40(42,43)44,41(45,46)47)28-9-13-30(14-10-28)57-38(51)34-18-16-32(20-26(34)6)53-22-55-36(49)24(3)4;1-23(2)35(39)47-21-45-29-11-17-33(25(5)19-29)37(41)49-27-7-13-31(14-8-27)51(43,44)32-15-9-28(10-16-32)50-38(42)34-18-12-30(20-26(34)6)46-22-48-36(40)24(3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h7-8,11-20,23-24H,1,3,9-10,21-22,25-26H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-8,11-20,23-24H,1,3,9-10,21-22,25-26H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-16H,1,3,17-18H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;28*1H4.

What are the key properties of [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate?

[4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate has a molecular weight of 6084.57 g/mol, XLogP of 76.95, 110 rotatable bonds, 0 hydrogen bond donors, and 76 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[2-[3,5-difluoro-4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2,6-difluorophenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[1,1,1,3,3,3-hexafluoro-2-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]propan-2-yl]phenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxopropyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;[4-[3-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-enyl]-3-methylphenoxy]methyl 2-methylprop-2-enoate;methane;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]propanoyloxy]phenyl]sulfonylphenoxy]-3-oxopropyl]phenoxy]methyl 2-methylprop-2-enoate;[3-methyl-4-[3-[4-[4-[3-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-enyl]phenoxy]methyl 2-methylprop-2-enoate;[4-[4-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoyl]oxyphenyl]sulfonylphenyl] 2-methyl-4-(2-methylprop-2-enoyloxymethoxy)benzoate is sourced from PubChem (CID 159990972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159990972 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.