2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen

C280H388F22O2 — CID 161414787

IUPAC2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen
SMILESC=CC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1.C=CCC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3F)c(F)c2F)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3F)cc2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)cc2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3F)cc2)CC1.CCC/C=C/C1CCC(C2CCC(c3ccc(C)c(F)c3F)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)c(F)c1F.Cc1ccc(C2=CCC(C)CC2)c(F)c1F.Cc1ccc(C2=CCC(C)CC2)c(F)c1F.Cc1ccc(C2=CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C2=CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(=O)C2CCC(C)CC2)c(F)c1F.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C26H30F4.C26H25F3.C26H32F2.C26H33F.C26H34.C24H34F2.C22H32.C21H30.2C20H26F2.C15H18F2O2.2C14H16F2.18H2/c1-15-3-7-17(8-4-15)19-11-13-21(25(29)23(19)27)22-14-12-20(24(28)26(22)30)18-9-5-16(2)6-10-18;1-16-3-6-18(7-4-16)19-8-10-20(11-9-19)22-14-12-21(15-24(22)27)23-13-5-17(2)25(28)26(23)29;1-17-3-7-19(8-4-17)20-11-13-22(14-12-20)24-16-15-23(25(27)26(24)28)21-9-5-18(2)6-10-21;1-18-3-7-20(8-4-18)21-11-13-23(14-12-21)25-16-15-24(17-26(25)27)22-9-5-19(2)6-10-22;1-19-3-7-21(8-4-19)23-11-15-25(16-12-23)26-17-13-24(14-18-26)22-9-5-20(2)6-10-22;1-3-4-5-6-18-8-10-19(11-9-18)20-12-14-21(15-13-20)22-16-7-17(2)23(25)24(22)26;1-3-4-18-7-11-20(12-8-18)22-15-13-21(14-16-22)19-9-5-17(2)6-10-19;1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)18-12-5-14(2)19(21)20(18)22;1-9-3-6-11(7-4-9)15(18)19-12-8-5-10(2)13(16)14(12)17;2*1-9-3-6-11(7-4-9)12-8-5-10(2)13(15)14(12)16;;;;;;;;;;;;;;;;;;/h11-18H,3-10H2,1-2H3;5,8-16,18H,3-4,6-7H2,1-2H3;11-19,21H,3-10H2,1-2H3;11-20,22H,3-10H2,1-2H3;11-22H,3-10H2,1-2H3;5-7,16,18-21H,3-4,8-15H2,1-2H3;3,5-6,9-10,18,20-22H,1,4,7-8,11-16H2,2H3;3-5,8-9,17,19-21H,1,6-7,10-15H2,2H3;2*5,10,12-13,15-16H,3-4,6-9,11H2,1-2H3;5,8-9,11H,3-4,6-7H2,1-2H3;2*5-6,8-9H,3-4,7H2,1-2H3;18*1H/b;;;;;6-5+;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyVVYAHTQIDOALCA-SQLGPEEISA-N
MW4204.14 g/mol
LogP91.35
Rot. Bonds35

About 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen

2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen (PubChem CID 161414787) has the molecular formula C280H388F22O2 and a molecular weight of 4204.14 g/mol. Its IUPAC name is 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen.

Molecular Properties

Compound Name2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen
PubChem CID161414787
Molecular FormulaC280H388F22O2
Molecular Weight4204.14 g/mol
Exact Mass4200.99
IUPAC Name2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen
SMILESC=CC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1.C=CCC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3F)c(F)c2F)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3F)cc2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)cc2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3F)cc2)CC1.CCC/C=C/C1CCC(C2CCC(c3ccc(C)c(F)c3F)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)c(F)c1F.Cc1ccc(C2=CCC(C)CC2)c(F)c1F.Cc1ccc(C2=CCC(C)CC2)c(F)c1F.Cc1ccc(C2=CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C2=CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(=O)C2CCC(C)CC2)c(F)c1F.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C26H30F4.C26H25F3.C26H32F2.C26H33F.C26H34.C24H34F2.C22H32.C21H30.2C20H26F2.C15H18F2O2.2C14H16F2.18H2/c1-15-3-7-17(8-4-15)19-11-13-21(25(29)23(19)27)22-14-12-20(24(28)26(22)30)18-9-5-16(2)6-10-18;1-16-3-6-18(7-4-16)19-8-10-20(11-9-19)22-14-12-21(15-24(22)27)23-13-5-17(2)25(28)26(23)29;1-17-3-7-19(8-4-17)20-11-13-22(14-12-20)24-16-15-23(25(27)26(24)28)21-9-5-18(2)6-10-21;1-18-3-7-20(8-4-18)21-11-13-23(14-12-21)25-16-15-24(17-26(25)27)22-9-5-19(2)6-10-22;1-19-3-7-21(8-4-19)23-11-15-25(16-12-23)26-17-13-24(14-18-26)22-9-5-20(2)6-10-22;1-3-4-5-6-18-8-10-19(11-9-18)20-12-14-21(15-13-20)22-16-7-17(2)23(25)24(22)26;1-3-4-18-7-11-20(12-8-18)22-15-13-21(14-16-22)19-9-5-17(2)6-10-19;1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)18-12-5-14(2)19(21)20(18)22;1-9-3-6-11(7-4-9)15(18)19-12-8-5-10(2)13(16)14(12)17;2*1-9-3-6-11(7-4-9)12-8-5-10(2)13(15)14(12)16;;;;;;;;;;;;;;;;;;/h11-18H,3-10H2,1-2H3;5,8-16,18H,3-4,6-7H2,1-2H3;11-19,21H,3-10H2,1-2H3;11-20,22H,3-10H2,1-2H3;11-22H,3-10H2,1-2H3;5-7,16,18-21H,3-4,8-15H2,1-2H3;3,5-6,9-10,18,20-22H,1,4,7-8,11-16H2,2H3;3-5,8-9,17,19-21H,1,6-7,10-15H2,2H3;2*5,10,12-13,15-16H,3-4,6-9,11H2,1-2H3;5,8-9,11H,3-4,6-7H2,1-2H3;2*5-6,8-9H,3-4,7H2,1-2H3;18*1H/b;;;;;6-5+;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyVVYAHTQIDOALCA-SQLGPEEISA-N
XLogP91.35
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds35
Heavy Atoms304
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004204.14
LogP ≤ 591.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen?
The IUPAC name of 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen (CID 161414787) is 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen.
What is the SMILES notation for 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen?
The canonical SMILES for 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen is C=CC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1.C=CCC1CCC(C2CCC(c3ccc(C)cc3)CC2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3F)c(F)c2F)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)c(F)c3F)cc2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)cc2)CC1.CC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3F)cc2)CC1.CCC/C=C/C1CCC(C2CCC(c3ccc(C)c(F)c3F)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)c(F)c1F.Cc1ccc(C2=CCC(C)CC2)c(F)c1F.Cc1ccc(C2=CCC(C)CC2)c(F)c1F.Cc1ccc(C2=CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C2=CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(OC(=O)C2CCC(C)CC2)c(F)c1F.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen?
The InChIKey is VVYAHTQIDOALCA-SQLGPEEISA-N. The full InChI is InChI=1S/C26H30F4.C26H25F3.C26H32F2.C26H33F.C26H34.C24H34F2.C22H32.C21H30.2C20H26F2.C15H18F2O2.2C14H16F2.18H2/c1-15-3-7-17(8-4-15)19-11-13-21(25(29)23(19)27)22-14-12-20(24(28)26(22)30)18-9-5-16(2)6-10-18;1-16-3-6-18(7-4-16)19-8-10-20(11-9-19)22-14-12-21(15-24(22)27)23-13-5-17(2)25(28)26(23)29;1-17-3-7-19(8-4-17)20-11-13-22(14-12-20)24-16-15-23(25(27)26(24)28)21-9-5-18(2)6-10-21;1-18-3-7-20(8-4-18)21-11-13-23(14-12-21)25-16-15-24(17-26(25)27)22-9-5-19(2)6-10-22;1-19-3-7-21(8-4-19)23-11-15-25(16-12-23)26-17-13-24(14-18-26)22-9-5-20(2)6-10-22;1-3-4-5-6-18-8-10-19(11-9-18)20-12-14-21(15-13-20)22-16-7-17(2)23(25)24(22)26;1-3-4-18-7-11-20(12-8-18)22-15-13-21(14-16-22)19-9-5-17(2)6-10-19;1-3-17-6-10-19(11-7-17)21-14-12-20(13-15-21)18-8-4-16(2)5-9-18;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)18-12-5-14(2)19(21)20(18)22;1-9-3-6-11(7-4-9)15(18)19-12-8-5-10(2)13(16)14(12)17;2*1-9-3-6-11(7-4-9)12-8-5-10(2)13(15)14(12)16;;;;;;;;;;;;;;;;;;/h11-18H,3-10H2,1-2H3;5,8-16,18H,3-4,6-7H2,1-2H3;11-19,21H,3-10H2,1-2H3;11-20,22H,3-10H2,1-2H3;11-22H,3-10H2,1-2H3;5-7,16,18-21H,3-4,8-15H2,1-2H3;3,5-6,9-10,18,20-22H,1,4,7-8,11-16H2,2H3;3-5,8-9,17,19-21H,1,6-7,10-15H2,2H3;2*5,10,12-13,15-16H,3-4,6-9,11H2,1-2H3;5,8-9,11H,3-4,6-7H2,1-2H3;2*5-6,8-9H,3-4,7H2,1-2H3;18*1H/b;;;;;6-5+;;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen?
2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen has a molecular weight of 4204.14 g/mol, XLogP of 91.35, 35 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-1-[3-fluoro-4-[4-(4-methylcyclohexyl)phenyl]phenyl]-4-methylbenzene;2,3-difluoro-1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-[2,3-difluoro-4-(4-methylcyclohexyl)phenyl]-2,3-difluoro-4-(4-methylcyclohexyl)benzene;bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexen-1-yl)benzene);bis(2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexen-1-yl]benzene);2,3-difluoro-1-methyl-4-[4-[4-[(E)-pent-1-enyl]cyclohexyl]cyclohexyl]benzene;(2,3-difluoro-4-methylphenyl) 4-methylcyclohexane-1-carboxylate;1-[4-(4-ethenylcyclohexyl)cyclohexyl]-4-methylbenzene;2-fluoro-4-(4-methylcyclohexyl)-1-[4-(4-methylcyclohexyl)phenyl]benzene;1-(4-methylcyclohexyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexyl]benzene;molecular hydrogen is sourced from PubChem (CID 161414787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).