1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate

C240H247F47O11 — CID 157396460

IUPAC1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate
SMILESCc1c(F)cc(C#Cc2c(F)cc(OC(F)(F)c3c(F)cc(C4CCC(C)CC4)cc3F)cc2F)cc1F.Cc1ccc(C#Cc2c(F)cc(OC(F)(F)c3c(F)cc(C4CCC(C)CC4)cc3F)cc2F)cc1F.Cc1ccc(C#Cc2ccc(OC(F)(F)c3ccc(C4CCC(C)CC4)cc3)cc2)cc1F.Cc1ccc(OC(=O)c2ccc(C3CCC(C)CC3)cc2F)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(CCC3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(C3CCC(C)CC3)cc2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(C3CCC(C)CC3)cc2F)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(CCC3CCC(C)CC3)cc2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(CCC3CCC(C)CC3)cc2F)c(F)c1F
InChIInChI=1S/C29H22F8O.C29H23F7O.C29H27F3O.C23H25F5O.C23H32F4O.C23H26F4O.C21H21F5O.C21H28F4O.C21H22F4O.C21H21F3O2/c1-15-3-6-18(7-4-15)19-11-26(34)28(27(35)12-19)29(36,37)38-20-13-24(32)21(25(33)14-20)8-5-17-9-22(30)16(2)23(31)10-17;1-16-3-8-19(9-4-16)20-12-26(33)28(27(34)13-20)29(35,36)37-21-14-24(31)22(25(32)15-21)10-7-18-6-5-17(2)23(30)11-18;1-20-3-11-24(12-4-20)25-13-15-26(16-14-25)29(31,32)33-27-17-9-22(10-18-27)7-8-23-6-5-21(2)28(30)19-23;1-14-3-6-16(7-4-14)8-9-17-10-11-18(19(24)13-17)23(27,28)29-20-12-5-15(2)21(25)22(20)26;2*1-15-3-6-17(7-4-15)8-9-18-10-12-19(13-11-18)23(26,27)28-20-14-5-16(2)21(24)22(20)25;1-12-3-6-14(7-4-12)15-8-9-16(17(22)11-15)21(25,26)27-18-10-5-13(2)19(23)20(18)24;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)21(24,25)26-18-12-5-14(2)19(22)20(18)23;1-12-3-6-14(7-4-12)15-8-9-16(17(22)11-15)21(25)26-18-10-5-13(2)19(23)20(18)24/h9-15,18H,3-4,6-7H2,1-2H3;5-6,11-16,19H,3-4,8-9H2,1-2H3;5-6,9-10,13-20,24H,3-4,11-12H2,1-2H3;5,10-14,16H,3-4,6-9H2,1-2H3;5,14-15,17-19H,3-4,6-13H2,1-2H3;5,10-15,17H,3-4,6-9H2,1-2H3;5,8-12,14H,3-4,6-7H2,1-2H3;5,12-13,15-17H,3-4,6-11H2,1-2H3;5,8-13,15H,3-4,6-7H2,1-2H3;5,8-12,14H,3-4,6-7H2,1-2H3
InChIKeyBMPXQKBZWKAQGB-UHFFFAOYSA-N
MW4200.51 g/mol
LogP73.57
Rot. Bonds45

About 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate

1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate (PubChem CID 157396460) has the molecular formula C240H247F47O11 and a molecular weight of 4200.51 g/mol. Its IUPAC name is 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate.

Molecular Properties

Compound Name1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate
PubChem CID157396460
Molecular FormulaC240H247F47O11
Molecular Weight4200.51 g/mol
Exact Mass4197.80
IUPAC Name1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate
SMILESCc1c(F)cc(C#Cc2c(F)cc(OC(F)(F)c3c(F)cc(C4CCC(C)CC4)cc3F)cc2F)cc1F.Cc1ccc(C#Cc2c(F)cc(OC(F)(F)c3c(F)cc(C4CCC(C)CC4)cc3F)cc2F)cc1F.Cc1ccc(C#Cc2ccc(OC(F)(F)c3ccc(C4CCC(C)CC4)cc3)cc2)cc1F.Cc1ccc(OC(=O)c2ccc(C3CCC(C)CC3)cc2F)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(CCC3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(C3CCC(C)CC3)cc2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(C3CCC(C)CC3)cc2F)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(CCC3CCC(C)CC3)cc2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(CCC3CCC(C)CC3)cc2F)c(F)c1F
InChIInChI=1S/C29H22F8O.C29H23F7O.C29H27F3O.C23H25F5O.C23H32F4O.C23H26F4O.C21H21F5O.C21H28F4O.C21H22F4O.C21H21F3O2/c1-15-3-6-18(7-4-15)19-11-26(34)28(27(35)12-19)29(36,37)38-20-13-24(32)21(25(33)14-20)8-5-17-9-22(30)16(2)23(31)10-17;1-16-3-8-19(9-4-16)20-12-26(33)28(27(34)13-20)29(35,36)37-21-14-24(31)22(25(32)15-21)10-7-18-6-5-17(2)23(30)11-18;1-20-3-11-24(12-4-20)25-13-15-26(16-14-25)29(31,32)33-27-17-9-22(10-18-27)7-8-23-6-5-21(2)28(30)19-23;1-14-3-6-16(7-4-14)8-9-17-10-11-18(19(24)13-17)23(27,28)29-20-12-5-15(2)21(25)22(20)26;2*1-15-3-6-17(7-4-15)8-9-18-10-12-19(13-11-18)23(26,27)28-20-14-5-16(2)21(24)22(20)25;1-12-3-6-14(7-4-12)15-8-9-16(17(22)11-15)21(25,26)27-18-10-5-13(2)19(23)20(18)24;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)21(24,25)26-18-12-5-14(2)19(22)20(18)23;1-12-3-6-14(7-4-12)15-8-9-16(17(22)11-15)21(25)26-18-10-5-13(2)19(23)20(18)24/h9-15,18H,3-4,6-7H2,1-2H3;5-6,11-16,19H,3-4,8-9H2,1-2H3;5-6,9-10,13-20,24H,3-4,11-12H2,1-2H3;5,10-14,16H,3-4,6-9H2,1-2H3;5,14-15,17-19H,3-4,6-13H2,1-2H3;5,10-15,17H,3-4,6-9H2,1-2H3;5,8-12,14H,3-4,6-7H2,1-2H3;5,12-13,15-17H,3-4,6-11H2,1-2H3;5,8-13,15H,3-4,6-7H2,1-2H3;5,8-12,14H,3-4,6-7H2,1-2H3
InChIKeyBMPXQKBZWKAQGB-UHFFFAOYSA-N
XLogP73.57
TPSA109.37 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds45
Heavy Atoms298
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004200.51
LogP ≤ 573.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate?
The IUPAC name of 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate (CID 157396460) is 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate.
What is the SMILES notation for 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate?
The canonical SMILES for 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate is Cc1c(F)cc(C#Cc2c(F)cc(OC(F)(F)c3c(F)cc(C4CCC(C)CC4)cc3F)cc2F)cc1F.Cc1ccc(C#Cc2c(F)cc(OC(F)(F)c3c(F)cc(C4CCC(C)CC4)cc3F)cc2F)cc1F.Cc1ccc(C#Cc2ccc(OC(F)(F)c3ccc(C4CCC(C)CC4)cc3)cc2)cc1F.Cc1ccc(OC(=O)c2ccc(C3CCC(C)CC3)cc2F)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(CCC3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(C3CCC(C)CC3)cc2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(C3CCC(C)CC3)cc2F)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(CCC3CCC(C)CC3)cc2)c(F)c1F.Cc1ccc(OC(F)(F)c2ccc(CCC3CCC(C)CC3)cc2F)c(F)c1F.
What is the InChIKey of 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate?
The InChIKey is BMPXQKBZWKAQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22F8O.C29H23F7O.C29H27F3O.C23H25F5O.C23H32F4O.C23H26F4O.C21H21F5O.C21H28F4O.C21H22F4O.C21H21F3O2/c1-15-3-6-18(7-4-15)19-11-26(34)28(27(35)12-19)29(36,37)38-20-13-24(32)21(25(33)14-20)8-5-17-9-22(30)16(2)23(31)10-17;1-16-3-8-19(9-4-16)20-12-26(33)28(27(34)13-20)29(35,36)37-21-14-24(31)22(25(32)15-21)10-7-18-6-5-17(2)23(30)11-18;1-20-3-11-24(12-4-20)25-13-15-26(16-14-25)29(31,32)33-27-17-9-22(10-18-27)7-8-23-6-5-21(2)28(30)19-23;1-14-3-6-16(7-4-14)8-9-17-10-11-18(19(24)13-17)23(27,28)29-20-12-5-15(2)21(25)22(20)26;2*1-15-3-6-17(7-4-15)8-9-18-10-12-19(13-11-18)23(26,27)28-20-14-5-16(2)21(24)22(20)25;1-12-3-6-14(7-4-12)15-8-9-16(17(22)11-15)21(25,26)27-18-10-5-13(2)19(23)20(18)24;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)21(24,25)26-18-12-5-14(2)19(22)20(18)23;1-12-3-6-14(7-4-12)15-8-9-16(17(22)11-15)21(25)26-18-10-5-13(2)19(23)20(18)24/h9-15,18H,3-4,6-7H2,1-2H3;5-6,11-16,19H,3-4,8-9H2,1-2H3;5-6,9-10,13-20,24H,3-4,11-12H2,1-2H3;5,10-14,16H,3-4,6-9H2,1-2H3;5,14-15,17-19H,3-4,6-13H2,1-2H3;5,10-15,17H,3-4,6-9H2,1-2H3;5,8-12,14H,3-4,6-7H2,1-2H3;5,12-13,15-17H,3-4,6-11H2,1-2H3;5,8-13,15H,3-4,6-7H2,1-2H3;5,8-12,14H,3-4,6-7H2,1-2H3.
What are the key properties of 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate?
1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate has a molecular weight of 4200.51 g/mol, XLogP of 73.57, 45 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[difluoro-[2-fluoro-4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[2-fluoro-4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;2-[[3,5-difluoro-4-[2-(3-fluoro-4-methylphenyl)ethynyl]phenoxy]-difluoromethyl]-1,3-difluoro-5-(4-methylcyclohexyl)benzene;1-[difluoro-[4-(4-methylcyclohexyl)cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]methoxy]-2,3-difluoro-4-methylbenzene;1-[difluoro-[4-[2-(4-methylcyclohexyl)ethyl]phenyl]methoxy]-2,3-difluoro-4-methylbenzene;5-[[2,6-difluoro-4-(4-methylcyclohexyl)phenyl]-difluoromethoxy]-2-[2-(3,5-difluoro-4-methylphenyl)ethynyl]-1,3-difluorobenzene;1-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]-2,3-difluoro-4-methylbenzene;4-[2-[4-[difluoro-[4-(4-methylcyclohexyl)phenyl]methoxy]phenyl]ethynyl]-2-fluoro-1-methylbenzene;(2,3-difluoro-4-methylphenyl) 2-fluoro-4-(4-methylcyclohexyl)benzoate is sourced from PubChem (CID 157396460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).