2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen

C149H216Cl5F17O3 — CID 158111278

About 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen

2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen (PubChem CID 158111278) has the molecular formula C149H216Cl5F17O3 and a molecular weight of 2555.59 g/mol. Its IUPAC name is 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen.

Molecular Properties

• Compound Name: 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen
• PubChem CID: 158111278
• Molecular Formula: C149H216Cl5F17O3
• Molecular Weight: 2555.59 g/mol
• Exact Mass: 2551.49
• IUPAC Name: 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen
• SMILES: Cc1ccc(C2CCC(C)CC2)c(Cl)c1F.Cc1ccc(C2CCC(C)CC2)c(Cl)c1F.Cc1ccc(C2CCC(C)CC2)c(F)c1Cl.Cc1ccc(C2CCC(C)CC2)c(F)c1Cl.Cc1ccc(C2CCC(C)CC2)c(F)c1F.Cc1ccc(C2CCC(C)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(COC2CCC(C)CC2)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(C)CC2)c(Cl)c1F.Cc1ccc(OCC2CCC(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]
• InChI: InChI=1S/C20H28F2.C15H18ClF3O.2C15H20F2O.4C14H18ClF.2C14H18F2.11H2/c1-13-3-6-15(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)20-12-8-5-10(2)14(17)13(12)16;1-10-3-7-13(8-4-10)18-9-12-6-5-11(2)14(16)15(12)17;1-10-3-6-12(7-4-10)9-18-13-8-5-11(2)14(16)15(13)17;2*1-9-3-6-11(7-4-9)12-8-5-10(2)14(16)13(12)15;4*1-9-3-6-11(7-4-9)12-8-5-10(2)13(15)14(12)16;;;;;;;;;;;/h5,12-13,15-17H,3-4,6-11H2,1-2H3;5,8-9,11H,3-4,6-7H2,1-2H3;5-6,10,13H,3-4,7-9H2,1-2H3;5,8,10,12H,3-4,6-7,9H2,1-2H3;6*5,8-9,11H,3-4,6-7H2,1-2H3;11*1H
• InChIKey: FQLREFSCJWCHNQ-UHFFFAOYSA-N
• XLogP: 52.97
• TPSA: 27.69 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 17
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2555.59
LogP ≤ 5	52.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen?

The IUPAC name of 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen (CID 158111278) is 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen.

What is the SMILES notation for 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen?

The canonical SMILES for 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen is Cc1ccc(C2CCC(C)CC2)c(Cl)c1F.Cc1ccc(C2CCC(C)CC2)c(Cl)c1F.Cc1ccc(C2CCC(C)CC2)c(F)c1Cl.Cc1ccc(C2CCC(C)CC2)c(F)c1Cl.Cc1ccc(C2CCC(C)CC2)c(F)c1F.Cc1ccc(C2CCC(C)CC2)c(F)c1F.Cc1ccc(C2CCC(C3CCC(C)CC3)CC2)c(F)c1F.Cc1ccc(COC2CCC(C)CC2)c(F)c1F.Cc1ccc(OC(F)(F)C2CCC(C)CC2)c(Cl)c1F.Cc1ccc(OCC2CCC(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].

What is the InChIKey of 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen?

The InChIKey is FQLREFSCJWCHNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28F2.C15H18ClF3O.2C15H20F2O.4C14H18ClF.2C14H18F2.11H2/c1-13-3-6-15(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)20-12-8-5-10(2)14(17)13(12)16;1-10-3-7-13(8-4-10)18-9-12-6-5-11(2)14(16)15(12)17;1-10-3-6-12(7-4-10)9-18-13-8-5-11(2)14(16)15(13)17;2*1-9-3-6-11(7-4-9)12-8-5-10(2)14(16)13(12)15;4*1-9-3-6-11(7-4-9)12-8-5-10(2)13(15)14(12)16;;;;;;;;;;;/h5,12-13,15-17H,3-4,6-11H2,1-2H3;5,8-9,11H,3-4,6-7H2,1-2H3;5-6,10,13H,3-4,7-9H2,1-2H3;5,8,10,12H,3-4,6-7,9H2,1-2H3;6*5,8-9,11H,3-4,6-7H2,1-2H3;11*1H.

What are the key properties of 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen?

2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen has a molecular weight of 2555.59 g/mol, XLogP of 52.97, 17 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-1-[difluoro-(4-methylcyclohexyl)methoxy]-3-fluoro-4-methylbenzene;bis(2-chloro-3-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(3-chloro-2-fluoro-1-methyl-4-(4-methylcyclohexyl)benzene);bis(2,3-difluoro-1-methyl-4-(4-methylcyclohexyl)benzene);2,3-difluoro-1-methyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)methoxy]benzene;2,3-difluoro-1-methyl-4-[(4-methylcyclohexyl)oxymethyl]benzene;molecular hydrogen is sourced from PubChem (CID 158111278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).