tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane

C288H388F10 — CID 157086367

About tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane

tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane (PubChem CID 157086367) has the molecular formula C288H388F10 and a molecular weight of 4040.25 g/mol. Its IUPAC name is tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane.

Molecular Properties

• Compound Name: tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane
• PubChem CID: 157086367
• Molecular Formula: C288H388F10
• Molecular Weight: 4040.25 g/mol
• Exact Mass: 4037.02
• IUPAC Name: tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane
• SMILES: C.CCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1
• InChI: InChI=1S/3C30H41F.3C29H39F.2C28H37F.2C27H35F.CH4/c3*1-3-4-5-6-23-9-13-26(14-10-23)28-19-20-29(30(31)21-28)27-17-15-25(16-18-27)24-11-7-22(2)8-12-24;3*1-3-4-5-22-8-12-25(13-9-22)27-18-19-28(29(30)20-27)26-16-14-24(15-17-26)23-10-6-21(2)7-11-23;2*1-3-4-21-7-11-24(12-8-21)26-17-18-27(28(29)19-26)25-15-13-23(14-16-25)22-9-5-20(2)6-10-22;2*1-3-20-6-10-23(11-7-20)25-16-17-26(27(28)18-25)24-14-12-22(13-15-24)21-8-4-19(2)5-9-21;/h3*15-24,26H,3-14H2,1-2H3;3*14-23,25H,3-13H2,1-2H3;2*13-22,24H,3-12H2,1-2H3;2*12-21,23H,3-11H2,1-2H3;1H4
• InChIKey: AEDBABYFZOBOCQ-UHFFFAOYSA-N
• XLogP: 91.97
• TPSA: 0.00 Ų
• Rotatable Bonds: 57
• Heavy Atoms: 298
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4040.25
LogP ≤ 5	91.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane?

The IUPAC name of tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane (CID 157086367) is tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane.

What is the SMILES notation for tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane?

The canonical SMILES for tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane is C.CCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(F)c2)CC1.

What is the InChIKey of tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane?

The InChIKey is AEDBABYFZOBOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C30H41F.3C29H39F.2C28H37F.2C27H35F.CH4/c3*1-3-4-5-6-23-9-13-26(14-10-23)28-19-20-29(30(31)21-28)27-17-15-25(16-18-27)24-11-7-22(2)8-12-24;3*1-3-4-5-22-8-12-25(13-9-22)27-18-19-28(29(30)20-27)26-16-14-24(15-17-26)23-10-6-21(2)7-11-23;2*1-3-4-21-7-11-24(12-8-21)26-17-18-27(28(29)19-26)25-15-13-23(14-16-25)22-9-5-20(2)6-10-22;2*1-3-20-6-10-23(11-7-20)25-16-17-26(27(28)18-25)24-14-12-22(13-15-24)21-8-4-19(2)5-9-21;/h3*15-24,26H,3-14H2,1-2H3;3*14-23,25H,3-13H2,1-2H3;2*13-22,24H,3-12H2,1-2H3;2*12-21,23H,3-11H2,1-2H3;1H4.

What are the key properties of tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane?

tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane has a molecular weight of 4040.25 g/mol, XLogP of 91.97, 57 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for tris(4-(4-butylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);bis(4-(4-ethylcyclohexyl)-2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]benzene);tris(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-pentylcyclohexyl)benzene);bis(2-fluoro-1-[4-(4-methylcyclohexyl)phenyl]-4-(4-propylcyclohexyl)benzene);methane is sourced from PubChem (CID 157086367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).