1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene

C26H22 — CID 58892346

IUPAC1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
SMILESCc1ccc(-c2cccc(-c3ccc(-c4ccccc4C)cc3)c2)cc1
InChIInChI=1S/C26H22/c1-19-10-12-21(13-11-19)24-7-5-8-25(18-24)22-14-16-23(17-15-22)26-9-4-3-6-20(26)2/h3-18H,1-2H3
InChIKeyWQUQQMJTCGFGKU-UHFFFAOYSA-N
MW334.46 g/mol
LogP7.30
Rot. Bonds3

About 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene

1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene (PubChem CID 58892346) has the molecular formula C26H22 and a molecular weight of 334.46 g/mol. Its IUPAC name is 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene.

Molecular Properties

Compound Name1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
PubChem CID58892346
Molecular FormulaC26H22
Molecular Weight334.46 g/mol
Exact Mass334.17
IUPAC Name1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
SMILESCc1ccc(-c2cccc(-c3ccc(-c4ccccc4C)cc3)c2)cc1
InChIInChI=1S/C26H22/c1-19-10-12-21(13-11-19)24-7-5-8-25(18-24)22-14-16-23(17-15-22)26-9-4-3-6-20(26)2/h3-18H,1-2H3
InChIKeyWQUQQMJTCGFGKU-UHFFFAOYSA-N
XLogP7.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.46
LogP ≤ 57.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-bis(4-methylphenyl)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-2-[3-(4-methylphenyl)phenyl]benzene;1-methyl-2-[4-(4-methylphenyl)phenyl]benzene;1-methyl-3-[3-(4-methylphenyl)phenyl]benzene;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene;1,3-xylene
CID 158071150
1,3-bis(4-methylphenyl)benzene;1,4-bis(4-methylphenyl)benzene;ethane;1-methyl-2-(2-methylphenyl)benzene;1-methyl-2-(3-methylphenyl)benzene;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(3-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-4-(4-methylphenyl)benzene
CID 158847391
1-methyl-2-[3-[4-[2-(3-methylphenyl)phenyl]phenyl]phenyl]benzene
CID 153455101
1,2-bis(3-methylphenyl)benzene;1,3-bis(3-methylphenyl)benzene;1-methyl-2-[2-(3-methylphenyl)phenyl]benzene;1-methyl-2-[3-(3-methylphenyl)phenyl]benzene;1-methyl-3-[3-(4-methylphenyl)phenyl]benzene;1-methyl-4-[2-(3-methylphenyl)phenyl]benzene
CID 162017354
ethane;1-methyl-2-(3-phenylphenyl)benzene;1-methyl-2-(4-phenylphenyl)benzene;1-methyl-3-(2-phenylphenyl)benzene;1-methyl-3-(3-phenylphenyl)benzene;1-methyl-3-(4-phenylphenyl)benzene;1-methyl-4-(3-phenylphenyl)benzene
CID 158292689
1-(2-methylphenyl)-3,5-diphenylbenzene;1-(3-methylphenyl)-3,5-diphenylbenzene;1-(4-methylphenyl)-3,5-diphenylbenzene
CID 163934955
1-methyl-2-[2-(4-phenylphenyl)phenyl]benzene;1-methyl-2-[3-(3-phenylphenyl)phenyl]benzene;1-methyl-2-[3-(4-phenylphenyl)phenyl]benzene;1-methyl-3-[2-(4-phenylphenyl)phenyl]benzene;1-methyl-4-[2-(4-phenylphenyl)phenyl]benzene
CID 157433128
1,1'-biphenyl;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene
CID 159346959
1,2-bis[3-(2-methylphenyl)phenyl]benzene;1,3-bis[3-(2-methylphenyl)phenyl]benzene;1,4-bis[3-(2-methylphenyl)phenyl]benzene;1,3-bis[3-(4-methylphenyl)phenyl]-5-phenylbenzene;1,4-bis[3-(4-methylphenyl)phenyl]-2-phenylbenzene;1,2-dimethyl-4,5-bis[3-(4-methylphenyl)phenyl]benzene
CID 158504879
1-methyl-4-[2-(3-phenylphenyl)phenyl]benzene
CID 58390014
ethane;1-methyl-2-(3-phenylphenyl)benzene
CID 142541189
1-methyl-2-[4-(4-phenylphenyl)phenyl]benzene
CID 58389745

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene?
The IUPAC name of 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene (CID 58892346) is 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene.
What is the SMILES notation for 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene?
The canonical SMILES for 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene is Cc1ccc(-c2cccc(-c3ccc(-c4ccccc4C)cc3)c2)cc1.
What is the InChIKey of 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene?
The InChIKey is WQUQQMJTCGFGKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22/c1-19-10-12-21(13-11-19)24-7-5-8-25(18-24)22-14-16-23(17-15-22)26-9-4-3-6-20(26)2/h3-18H,1-2H3.
What are the key properties of 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene?
1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene has a molecular weight of 334.46 g/mol, XLogP of 7.30, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene is sourced from PubChem (CID 58892346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).