1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene

C122H172F8O3 — CID 162198901

About 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene

1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene (PubChem CID 162198901) has the molecular formula C122H172F8O3 and a molecular weight of 1838.70 g/mol. Its IUPAC name is 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene.

Molecular Properties

• Compound Name: 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene
• PubChem CID: 162198901
• Molecular Formula: C122H172F8O3
• Molecular Weight: 1838.70 g/mol
• Exact Mass: 1837.32
• IUPAC Name: 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene
• SMILES: C=CC1CCC(C2CCC(CCC)CC2)CC1.CCCC1CCC(=C2CCC(c3ccc(OCC)c(F)c3F)CC2)CC1.CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)cc2)CC1.CCCC1CCC(c2ccc(OCC)c(F)c2F)CC1.CCCCC1CCC(C2CCC(CCC)CC2)CC1.CCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2F)cc1
• InChI: InChI=1S/C23H32F2O.C23H28F2O.C23H22F2.C19H36.C17H24F2O.C17H30/c2*1-3-5-16-6-8-17(9-7-16)18-10-12-19(13-11-18)20-14-15-21(26-4-2)23(25)22(20)24;1-3-5-17-8-12-19(13-9-17)21-15-14-20(22(24)23(21)25)18-10-6-16(4-2)7-11-18;1-3-5-7-17-10-14-19(15-11-17)18-12-8-16(6-4-2)9-13-18;1-3-5-12-6-8-13(9-7-12)14-10-11-15(20-4-2)17(19)16(14)18;1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16/h14-16,19H,3-13H2,1-2H3;10-17H,3-9H2,1-2H3;6-15H,3-5H2,1-2H3;16-19H,3-15H2,1-2H3;10-13H,3-9H2,1-2H3;4,14-17H,2-3,5-13H2,1H3/b18-17-
• InChIKey: ZRHWELIAUMULIP-WSPBKSRESA-N
• XLogP: 38.84
• TPSA: 27.69 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 31
• Heavy Atoms: 133
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1838.70
LogP ≤ 5	38.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene?

The IUPAC name of 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene (CID 162198901) is 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene.

What is the SMILES notation for 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene?

The canonical SMILES for 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene is C=CC1CCC(C2CCC(CCC)CC2)CC1.CCCC1CCC(=C2CCC(c3ccc(OCC)c(F)c3F)CC2)CC1.CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)cc2)CC1.CCCC1CCC(c2ccc(OCC)c(F)c2F)CC1.CCCCC1CCC(C2CCC(CCC)CC2)CC1.CCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c(F)c2F)cc1.

What is the InChIKey of 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene?

The InChIKey is ZRHWELIAUMULIP-WSPBKSRESA-N. The full InChI is InChI=1S/C23H32F2O.C23H28F2O.C23H22F2.C19H36.C17H24F2O.C17H30/c2*1-3-5-16-6-8-17(9-7-16)18-10-12-19(13-11-18)20-14-15-21(26-4-2)23(25)22(20)24;1-3-5-17-8-12-19(13-9-17)21-15-14-20(22(24)23(21)25)18-10-6-16(4-2)7-11-18;1-3-5-7-17-10-14-19(15-11-17)18-12-8-16(6-4-2)9-13-18;1-3-5-12-6-8-13(9-7-12)14-10-11-15(20-4-2)17(19)16(14)18;1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16/h14-16,19H,3-13H2,1-2H3;10-17H,3-9H2,1-2H3;6-15H,3-5H2,1-2H3;16-19H,3-15H2,1-2H3;10-13H,3-9H2,1-2H3;4,14-17H,2-3,5-13H2,1H3/b18-17-;;;;;.

What are the key properties of 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene?

1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene has a molecular weight of 1838.70 g/mol, XLogP of 38.84, 31 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 1-butyl-4-(4-propylcyclohexyl)cyclohexane;1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethoxy-2,3-difluoro-4-(4-propylcyclohexyl)benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexylidene)cyclohexyl]benzene;1-ethoxy-2,3-difluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene;1-(4-ethylphenyl)-2,3-difluoro-4-(4-propylphenyl)benzene is sourced from PubChem (CID 162198901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).