bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol

C173H242F16O5 — CID 163834983

About bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol

bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol (PubChem CID 163834983) has the molecular formula C173H242F16O5 and a molecular weight of 2705.80 g/mol. Its IUPAC name is bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol.

Molecular Properties

• Compound Name: bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol
• PubChem CID: 163834983
• Molecular Formula: C173H242F16O5
• Molecular Weight: 2705.80 g/mol
• Exact Mass: 2703.84
• IUPAC Name: bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol
• SMILES: CC1CCC(C2CCC(c3ccc(OC4CC4)c(F)c3F)CC2)CC1.CC1CCC(C2CCC(c3ccc(OC4CCCC4)c(F)c3F)CC2)CC1.Cc1ccc(C(O)C2CCC(C)CC2)c(F)c1F.Cc1ccc(C(O)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C(O)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C4CC4)CC3)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C4CCCC4)CC3)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C4CCCC4)CC3)CC2)c(F)c1F
• InChI: InChI=1S/C24H34F2O.2C24H34F2.C22H30F2O.C22H30F2.2C21H30F2O.C15H20F2O/c1-16-6-8-17(9-7-16)18-10-12-19(13-11-18)21-14-15-22(24(26)23(21)25)27-20-4-2-3-5-20;2*1-16-6-15-22(24(26)23(16)25)21-13-11-20(12-14-21)19-9-7-18(8-10-19)17-4-2-3-5-17;1-14-2-4-15(5-3-14)16-6-8-17(9-7-16)19-12-13-20(22(24)21(19)23)25-18-10-11-18;1-14-2-13-20(22(24)21(14)23)19-11-9-18(10-12-19)17-7-5-16(6-8-17)15-3-4-15;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)21(24)18-12-5-14(2)19(22)20(18)23;1-9-3-6-11(7-4-9)15(18)12-8-5-10(2)13(16)14(12)17/h14-20H,2-13H2,1H3;2*6,15,17-21H,2-5,7-14H2,1H3;12-18H,2-11H2,1H3;2,13,15-19H,3-12H2,1H3;2*5,12-13,15-17,21,24H,3-4,6-11H2,1-2H3;5,8-9,11,15,18H,3-4,6-7H2,1-2H3
• InChIKey: OGYYBLLDRRCNME-UHFFFAOYSA-N
• XLogP: 51.85
• TPSA: 79.15 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 25
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2705.80
LogP ≤ 5	51.85
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol?

The IUPAC name of bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol (CID 163834983) is bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol.

What is the SMILES notation for bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol?

The canonical SMILES for bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol is CC1CCC(C2CCC(c3ccc(OC4CC4)c(F)c3F)CC2)CC1.CC1CCC(C2CCC(c3ccc(OC4CCCC4)c(F)c3F)CC2)CC1.Cc1ccc(C(O)C2CCC(C)CC2)c(F)c1F.Cc1ccc(C(O)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C(O)C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C4CC4)CC3)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C4CCCC4)CC3)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C4CCCC4)CC3)CC2)c(F)c1F.

What is the InChIKey of bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol?

The InChIKey is OGYYBLLDRRCNME-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34F2O.2C24H34F2.C22H30F2O.C22H30F2.2C21H30F2O.C15H20F2O/c1-16-6-8-17(9-7-16)18-10-12-19(13-11-18)21-14-15-22(24(26)23(21)25)27-20-4-2-3-5-20;2*1-16-6-15-22(24(26)23(16)25)21-13-11-20(12-14-21)19-9-7-18(8-10-19)17-4-2-3-5-17;1-14-2-4-15(5-3-14)16-6-8-17(9-7-16)19-12-13-20(22(24)21(19)23)25-18-10-11-18;1-14-2-13-20(22(24)21(14)23)19-11-9-18(10-12-19)17-7-5-16(6-8-17)15-3-4-15;2*1-13-3-6-15(7-4-13)16-8-10-17(11-9-16)21(24)18-12-5-14(2)19(22)20(18)23;1-9-3-6-11(7-4-9)15(18)12-8-5-10(2)13(16)14(12)17/h14-20H,2-13H2,1H3;2*6,15,17-21H,2-5,7-14H2,1H3;12-18H,2-11H2,1H3;2,13,15-19H,3-12H2,1H3;2*5,12-13,15-17,21,24H,3-4,6-11H2,1-2H3;5,8-9,11,15,18H,3-4,6-7H2,1-2H3.

What are the key properties of bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol?

bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol has a molecular weight of 2705.80 g/mol, XLogP of 51.85, 25 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol is sourced from PubChem (CID 163834983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).