1-methyl-2-(4-phenylphenyl)benzene

C38H32 — CID 144588078

IUPAC1-methyl-2-(4-phenylphenyl)benzene
SMILESCc1ccccc1-c1ccc(-c2ccccc2)cc1.Cc1ccccc1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/2C19H16/c2*1-15-7-5-6-10-19(15)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2*2-14H,1H3
InChIKeyZBLNNCULYYZCNV-UHFFFAOYSA-N
MW488.67 g/mol
LogP10.66
Rot. Bonds4

About 1-methyl-2-(4-phenylphenyl)benzene

1-methyl-2-(4-phenylphenyl)benzene (PubChem CID 144588078) has the molecular formula C38H32 and a molecular weight of 488.67 g/mol. Its IUPAC name is 1-methyl-2-(4-phenylphenyl)benzene.

Molecular Properties

Compound Name1-methyl-2-(4-phenylphenyl)benzene
PubChem CID144588078
Molecular FormulaC38H32
Molecular Weight488.67 g/mol
Exact Mass488.25
IUPAC Name1-methyl-2-(4-phenylphenyl)benzene
SMILESCc1ccccc1-c1ccc(-c2ccccc2)cc1.Cc1ccccc1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/2C19H16/c2*1-15-7-5-6-10-19(15)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2*2-14H,1H3
InChIKeyZBLNNCULYYZCNV-UHFFFAOYSA-N
XLogP10.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.67
LogP ≤ 510.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-2-[4-(4-phenylphenyl)phenyl]benzene
CID 58389745
1-methyl-2-[4-(2-phenylphenyl)phenyl]benzene
CID 58390061
4-(2-methylphenyl)-1,2-diphenylbenzene
CID 59171693
1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892346
1-methyl-2-[2-[4-(2-methylphenyl)phenyl]phenyl]benzene
CID 58892394
1-methyl-2-phenylbenzene;prop-1-ene
CID 144960650
1-methyl-2-phenylbenzene;sulfane;trifluoroborane
CID 175768148
1,1'-biphenyl;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene
CID 159346959
ethane;1-methyl-2-(3-phenylphenyl)benzene
CID 142541189
1-methyl-2-phenylbenzene;phosphoric acid
CID 159087333
1,1'-biphenyl;1,2-dimethyl-3-phenylbenzene
CID 173440409
1,2-dimethyl-3-[2-(4-phenylphenyl)phenyl]benzene
CID 171799040

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(4-phenylphenyl)benzene?
The IUPAC name of 1-methyl-2-(4-phenylphenyl)benzene (CID 144588078) is 1-methyl-2-(4-phenylphenyl)benzene.
What is the SMILES notation for 1-methyl-2-(4-phenylphenyl)benzene?
The canonical SMILES for 1-methyl-2-(4-phenylphenyl)benzene is Cc1ccccc1-c1ccc(-c2ccccc2)cc1.Cc1ccccc1-c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-methyl-2-(4-phenylphenyl)benzene?
The InChIKey is ZBLNNCULYYZCNV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H16/c2*1-15-7-5-6-10-19(15)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2*2-14H,1H3.
What are the key properties of 1-methyl-2-(4-phenylphenyl)benzene?
1-methyl-2-(4-phenylphenyl)benzene has a molecular weight of 488.67 g/mol, XLogP of 10.66, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(4-phenylphenyl)benzene is sourced from PubChem (CID 144588078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).