2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene

C152H236F20O3 — CID 157486155

About 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene

2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene (PubChem CID 157486155) has the molecular formula C152H236F20O3 and a molecular weight of 2491.52 g/mol. Its IUPAC name is 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene.

Molecular Properties

• Compound Name: 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene
• PubChem CID: 157486155
• Molecular Formula: C152H236F20O3
• Molecular Weight: 2491.52 g/mol
• Exact Mass: 2489.80
• IUPAC Name: 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene
• SMILES: CC1CCC(C2CCC(c3cc(F)c(F)c(F)c3)CC2)CC1.CC1CCC(C2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1.CC1CCC(c2ccc(F)cc2)CC1.Cc1cc(C2CCC(C)CC2)cc(F)c1F.Cc1cc(C2CCC(C3CCC(C)CC3)CC2)cc(F)c1OC(F)(F)F.Cc1cc(C2CCC(C3CCC(C)CC3)CC2)cc(F)c1OC(F)F.Cc1cc(C2CCC(CCC3CCC(C)CC3)CC2)cc(F)c1F.Cc1cc(CCC2CCC(C3CCC(C)CC3)CC2)cc(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]
• InChI: InChI=1S/2C22H32F2.C21H28F4O.C21H29F3O.C20H27F3O.C19H25F3.C14H18F2.C13H17F.14H2/c1-15-3-9-19(10-4-15)20-11-7-17(8-12-20)5-6-18-13-16(2)22(24)21(23)14-18;1-15-3-5-17(6-4-15)7-8-18-9-11-19(12-10-18)20-13-16(2)22(24)21(23)14-20;1-13-3-5-15(6-4-13)16-7-9-17(10-8-16)18-11-14(2)20(19(22)12-18)26-21(23,24)25;1-13-3-5-15(6-4-13)16-7-9-17(10-8-16)18-11-14(2)20(19(22)12-18)25-21(23)24;1-14-2-4-15(5-3-14)16-6-8-17(9-7-16)18-10-12-19(13-11-18)24-20(21,22)23;1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)16-10-17(20)19(22)18(21)11-16;1-9-3-5-11(6-4-9)12-7-10(2)14(16)13(15)8-12;1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12;;;;;;;;;;;;;;/h13-15,17,19-20H,3-12H2,1-2H3;13-15,17-19H,3-12H2,1-2H3;11-13,15-17H,3-10H2,1-2H3;11-13,15-17,21H,3-10H2,1-2H3;10-17H,2-9H2,1H3;10-15H,2-9H2,1H3;7-9,11H,3-6H2,1-2H3;6-11H,2-5H2,1H3;14*1H
• InChIKey: BWSUGMZRWTUXCL-UHFFFAOYSA-N
• XLogP: 52.98
• TPSA: 27.69 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 22
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2491.52
LogP ≤ 5	52.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene?

The IUPAC name of 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene (CID 157486155) is 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene.

What is the SMILES notation for 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene?

The canonical SMILES for 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene is CC1CCC(C2CCC(c3cc(F)c(F)c(F)c3)CC2)CC1.CC1CCC(C2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1.CC1CCC(c2ccc(F)cc2)CC1.Cc1cc(C2CCC(C)CC2)cc(F)c1F.Cc1cc(C2CCC(C3CCC(C)CC3)CC2)cc(F)c1OC(F)(F)F.Cc1cc(C2CCC(C3CCC(C)CC3)CC2)cc(F)c1OC(F)F.Cc1cc(C2CCC(CCC3CCC(C)CC3)CC2)cc(F)c1F.Cc1cc(CCC2CCC(C3CCC(C)CC3)CC2)cc(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].

What is the InChIKey of 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene?

The InChIKey is BWSUGMZRWTUXCL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H32F2.C21H28F4O.C21H29F3O.C20H27F3O.C19H25F3.C14H18F2.C13H17F.14H2/c1-15-3-9-19(10-4-15)20-11-7-17(8-12-20)5-6-18-13-16(2)22(24)21(23)14-18;1-15-3-5-17(6-4-15)7-8-18-9-11-19(12-10-18)20-13-16(2)22(24)21(23)14-20;1-13-3-5-15(6-4-13)16-7-9-17(10-8-16)18-11-14(2)20(19(22)12-18)26-21(23,24)25;1-13-3-5-15(6-4-13)16-7-9-17(10-8-16)18-11-14(2)20(19(22)12-18)25-21(23)24;1-14-2-4-15(5-3-14)16-6-8-17(9-7-16)18-10-12-19(13-11-18)24-20(21,22)23;1-12-2-4-13(5-3-12)14-6-8-15(9-7-14)16-10-17(20)19(22)18(21)11-16;1-9-3-5-11(6-4-9)12-7-10(2)14(16)13(15)8-12;1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12;;;;;;;;;;;;;;/h13-15,17,19-20H,3-12H2,1-2H3;13-15,17-19H,3-12H2,1-2H3;11-13,15-17H,3-10H2,1-2H3;11-13,15-17,21H,3-10H2,1-2H3;10-17H,2-9H2,1H3;10-15H,2-9H2,1H3;7-9,11H,3-6H2,1-2H3;6-11H,2-5H2,1H3;14*1H.

What are the key properties of 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene?

2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene has a molecular weight of 2491.52 g/mol, XLogP of 52.98, 22 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(difluoromethoxy)-1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1,2-difluoro-3-methyl-5-(4-methylcyclohexyl)benzene;1,2-difluoro-3-methyl-5-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]benzene;1,2-difluoro-3-methyl-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-fluoro-4-(4-methylcyclohexyl)benzene;1-fluoro-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]-2-(trifluoromethoxy)benzene;1-[4-(4-methylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene;molecular hydrogen;1,2,3-trifluoro-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene is sourced from PubChem (CID 157486155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).