1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene

C133H160F2O — CID 167583107

IUPAC1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene
SMILESCC1CCC(C2CCC(C)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(-c2ccc(C3CCC(C)CC3)cc2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(C2CCC(c3ccc(C)cc3)CC2)cc1.Cc1ccc(CCc2ccc(C)cc2)cc1.Cc1ccc(F)cc1.Cc1ccc(OCF)cc1
InChIInChI=1S/2C20H24.C20H18.C16H18.C14H26.C14H20.C14H14.C8H9FO.C7H7F/c3*1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-13-3-7-15(8-4-13)11-12-16-9-5-14(2)6-10-16;3*1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-2-4-8(5-3-7)10-6-9;1-6-2-4-7(8)5-3-6/h3-4,7-8,11-14,16,18H,5-6,9-10H2,1-2H3;3-10,19-20H,11-14H2,1-2H3;3-14H,1-2H3;3-10H,11-12H2,1-2H3;11-14H,3-10H2,1-2H3;3-4,7-8,12,14H,5-6,9-10H2,1-2H3;3-10H,1-2H3;2-5H,6H2,1H3;2-5H,1H3
InChIKeyHLDVSHFFTHPSDO-UHFFFAOYSA-N
MW1812.74 g/mol
LogP38.76
Rot. Bonds14

About 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene

1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene (PubChem CID 167583107) has the molecular formula C133H160F2O and a molecular weight of 1812.74 g/mol. Its IUPAC name is 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene.

Molecular Properties

Compound Name1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene
PubChem CID167583107
Molecular FormulaC133H160F2O
Molecular Weight1812.74 g/mol
Exact Mass1811.24
IUPAC Name1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene
SMILESCC1CCC(C2CCC(C)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(-c2ccc(C3CCC(C)CC3)cc2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(C2CCC(c3ccc(C)cc3)CC2)cc1.Cc1ccc(CCc2ccc(C)cc2)cc1.Cc1ccc(F)cc1.Cc1ccc(OCF)cc1
InChIInChI=1S/2C20H24.C20H18.C16H18.C14H26.C14H20.C14H14.C8H9FO.C7H7F/c3*1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-13-3-7-15(8-4-13)11-12-16-9-5-14(2)6-10-16;3*1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-2-4-8(5-3-7)10-6-9;1-6-2-4-7(8)5-3-6/h3-4,7-8,11-14,16,18H,5-6,9-10H2,1-2H3;3-10,19-20H,11-14H2,1-2H3;3-14H,1-2H3;3-10H,11-12H2,1-2H3;11-14H,3-10H2,1-2H3;3-4,7-8,12,14H,5-6,9-10H2,1-2H3;3-10H,1-2H3;2-5H,6H2,1H3;2-5H,1H3
InChIKeyHLDVSHFFTHPSDO-UHFFFAOYSA-N
XLogP38.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms136
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001812.74
LogP ≤ 538.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene?
The IUPAC name of 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene (CID 167583107) is 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene.
What is the SMILES notation for 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene?
The canonical SMILES for 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene is CC1CCC(C2CCC(C)CC2)CC1.Cc1ccc(-c2ccc(-c3ccc(C)cc3)cc2)cc1.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(-c2ccc(C3CCC(C)CC3)cc2)cc1.Cc1ccc(C2CCC(C)CC2)cc1.Cc1ccc(C2CCC(c3ccc(C)cc3)CC2)cc1.Cc1ccc(CCc2ccc(C)cc2)cc1.Cc1ccc(F)cc1.Cc1ccc(OCF)cc1.
What is the InChIKey of 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene?
The InChIKey is HLDVSHFFTHPSDO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H24.C20H18.C16H18.C14H26.C14H20.C14H14.C8H9FO.C7H7F/c3*1-15-3-7-17(8-4-15)19-11-13-20(14-12-19)18-9-5-16(2)6-10-18;1-13-3-7-15(8-4-13)11-12-16-9-5-14(2)6-10-16;3*1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-2-4-8(5-3-7)10-6-9;1-6-2-4-7(8)5-3-6/h3-4,7-8,11-14,16,18H,5-6,9-10H2,1-2H3;3-10,19-20H,11-14H2,1-2H3;3-14H,1-2H3;3-10H,11-12H2,1-2H3;11-14H,3-10H2,1-2H3;3-4,7-8,12,14H,5-6,9-10H2,1-2H3;3-10H,1-2H3;2-5H,6H2,1H3;2-5H,1H3.
What are the key properties of 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene?
1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene has a molecular weight of 1812.74 g/mol, XLogP of 38.76, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(4-methylphenyl)benzene;1-(fluoromethoxy)-4-methylbenzene;1-fluoro-4-methylbenzene;1-methyl-4-(4-methylcyclohexyl)benzene;1-methyl-4-(4-methylcyclohexyl)cyclohexane;1-methyl-4-[4-(4-methylcyclohexyl)phenyl]benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[4-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[2-(4-methylphenyl)ethyl]benzene is sourced from PubChem (CID 167583107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).