[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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

C253H220F18O66S3 — CID 157383316

IUPAC[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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
SMILESC=C(C)C(=O)OCOc1ccc(C(=C)C(=O)Oc2ccc(C(c3ccc(OC(=O)C(=C)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(=C)C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)C(=C)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)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
InChIInChI=1S/2C45H38F6O10.2C42H38O12S.C41H34F6O10.C38H34O12S/c1-27(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;1-25(2)39(52)58-23-56-35-17-19-37(27(5)21-35)29(7)41(54)60-33-13-9-31(10-14-33)43(44(46,47)48,45(49,50)51)32-11-15-34(16-12-32)61-42(55)30(8)38-20-18-36(22-28(38)6)57-24-59-40(53)26(3)4;1-25(2)39(43)51-23-49-33-13-19-37(27(5)21-33)29(7)41(45)53-31-9-15-35(16-10-31)55(47,48)36-17-11-32(12-18-36)54-42(46)30(8)38-20-14-34(22-28(38)6)50-24-52-40(44)26(3)4;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;1-23(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/h7-24H,1,3,25-26H2,2,4-6H3;9-22H,1,3,7-8,23-24H2,2,4-6H3;9-22H,1,3,7-8,23-24H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3
InChIKeyBLDIOFZVTKQOLO-UHFFFAOYSA-N
MW4754.64 g/mol
LogP49.85
Rot. Bonds92

About [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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-[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 157383316) has the molecular formula C253H220F18O66S3 and a molecular weight of 4754.64 g/mol. Its IUPAC name is [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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-[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 CID157383316
Molecular FormulaC253H220F18O66S3
Molecular Weight4754.64 g/mol
Exact Mass4751.27
IUPAC Name[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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
SMILESC=C(C)C(=O)OCOc1ccc(C(=C)C(=O)Oc2ccc(C(c3ccc(OC(=O)C(=C)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(=C)C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)C(=C)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)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
InChIInChI=1S/2C45H38F6O10.2C42H38O12S.C41H34F6O10.C38H34O12S/c1-27(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;1-25(2)39(52)58-23-56-35-17-19-37(27(5)21-35)29(7)41(54)60-33-13-9-31(10-14-33)43(44(46,47)48,45(49,50)51)32-11-15-34(16-12-32)61-42(55)30(8)38-20-18-36(22-28(38)6)57-24-59-40(53)26(3)4;1-25(2)39(43)51-23-49-33-13-19-37(27(5)21-33)29(7)41(45)53-31-9-15-35(16-10-31)55(47,48)36-17-11-32(12-18-36)54-42(46)30(8)38-20-14-34(22-28(38)6)50-24-52-40(44)26(3)4;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;1-23(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/h7-24H,1,3,25-26H2,2,4-6H3;9-22H,1,3,7-8,23-24H2,2,4-6H3;9-22H,1,3,7-8,23-24H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3
InChIKeyBLDIOFZVTKQOLO-UHFFFAOYSA-N
XLogP49.85
TPSA844.38 Ų
H-Bond Donors
H-Bond Acceptors66
Rotatable Bonds92
Heavy Atoms340
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004754.64
LogP ≤ 549.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1066

Analyze [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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-[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 157383316) is [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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-[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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-[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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(=O)OCOc1ccc(C(=C)C(=O)Oc2ccc(C(c3ccc(OC(=O)C(=C)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(=C)C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)C(=C)c4ccc(OCOC(=O)C(=C)C)cc4C)cc3)cc2)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.
What is the InChIKey of [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 BLDIOFZVTKQOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C45H38F6O10.2C42H38O12S.C41H34F6O10.C38H34O12S/c1-27(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;1-25(2)39(52)58-23-56-35-17-19-37(27(5)21-35)29(7)41(54)60-33-13-9-31(10-14-33)43(44(46,47)48,45(49,50)51)32-11-15-34(16-12-32)61-42(55)30(8)38-20-18-36(22-28(38)6)57-24-59-40(53)26(3)4;1-25(2)39(43)51-23-49-33-13-19-37(27(5)21-33)29(7)41(45)53-31-9-15-35(16-10-31)55(47,48)36-17-11-32(12-18-36)54-42(46)30(8)38-20-14-34(22-28(38)6)50-24-52-40(44)26(3)4;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;1-23(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/h7-24H,1,3,25-26H2,2,4-6H3;9-22H,1,3,7-8,23-24H2,2,4-6H3;9-22H,1,3,7-8,23-24H2,2,4-6H3;7-24H,1,3,25-26H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3;7-20H,1,3,21-22H2,2,4-6H3.
What are the key properties of [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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-[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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 4754.64 g/mol, XLogP of 49.85, 92 rotatable bonds, 0 hydrogen bond donors, and 66 hydrogen bond acceptors.
Where does this data come from?
All data for [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-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]propan-2-yl]phenoxy]-3-oxoprop-1-en-2-yl]-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;[3-methyl-4-[3-[4-[4-[2-[2-methyl-4-(2-methylprop-2-enoyloxymethoxy)phenyl]prop-2-enoyloxy]phenyl]sulfonylphenoxy]-3-oxoprop-1-en-2-yl]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 157383316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).