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

C27H24 — CID 58892414

IUPAC4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene
SMILESCc1ccc(-c2cccc(-c3cc(C)ccc3-c3ccc(C)cc3)c2)cc1
InChIInChI=1S/C27H24/c1-19-7-12-22(13-8-19)24-5-4-6-25(18-24)27-17-21(3)11-16-26(27)23-14-9-20(2)10-15-23/h4-18H,1-3H3
InChIKeyHXJBILZADNONFA-UHFFFAOYSA-N
MW348.49 g/mol
LogP7.61
Rot. Bonds3

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

4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene (PubChem CID 58892414) has the molecular formula C27H24 and a molecular weight of 348.49 g/mol. Its IUPAC name is 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene.

Molecular Properties

Compound Name4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene
PubChem CID58892414
Molecular FormulaC27H24
Molecular Weight348.49 g/mol
Exact Mass348.19
IUPAC Name4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene
SMILESCc1ccc(-c2cccc(-c3cc(C)ccc3-c3ccc(C)cc3)c2)cc1
InChIInChI=1S/C27H24/c1-19-7-12-22(13-8-19)24-5-4-6-25(18-24)27-17-21(3)11-16-26(27)23-14-9-20(2)10-15-23/h4-18H,1-3H3
InChIKeyHXJBILZADNONFA-UHFFFAOYSA-N
XLogP7.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.49
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-4-[2-(3-phenylphenyl)phenyl]benzene
CID 58390014
1-methyl-2,4-diphenylbenzene;1-methyl-3,5-diphenylbenzene;4-methyl-1,2-diphenylbenzene;1-methyl-3-[2-(2-phenylphenyl)phenyl]benzene;1-methyl-3-[2-(3-phenylphenyl)phenyl]benzene;1-methyl-4-[2-(2-phenylphenyl)phenyl]benzene
CID 161087634
1-methyl-3-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892418
4-(3-methylphenyl)-1,2-diphenylbenzene
CID 59171658
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
1,4-bis[3-(3,5-dimethylphenyl)phenyl]-2-phenylbenzene
CID 59552818
[2-[3-(4-methyl-2-phenylphenyl)phenyl]phenyl]phosphane
CID 134321167
1-(3,5-dimethylphenyl)-4-[3-(3,5-dimethylphenyl)phenyl]-2-phenylbenzene;1-[3-[2-[3-(3,5-dimethylphenyl)phenyl]phenyl]phenyl]-3,5-dimethylbenzene;bis(1-[3-[4-[3-(3,5-dimethylphenyl)phenyl]phenyl]phenyl]-3,5-dimethylbenzene)
CID 159368011
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-2,3-diphenylbenzene;4-methyl-1,2-diphenylbenzene;1-methyl-2-(2-phenylphenyl)benzene;1-methyl-2-(3-phenylphenyl)benzene;1-methyl-3-(2-phenylphenyl)benzene;1-methyl-3-(3-phenylphenyl)benzene;1-methyl-4-(3-phenylphenyl)benzene
CID 162010466
1-methyl-2,4-diphenylbenzene;1-methyl-3,5-diphenylbenzene;4-methyl-1,2-diphenylbenzene;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene;1-methyl-4-phenylbenzene;1-(3-methylphenyl)-3,5-diphenylbenzene;1-methyl-3-(3-phenylphenyl)benzene
CID 161146851
1-methyl-2-[3-[4-[2-(3-methylphenyl)phenyl]phenyl]phenyl]benzene
CID 153455101

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene?
The IUPAC name of 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene (CID 58892414) is 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene.
What is the SMILES notation for 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene?
The canonical SMILES for 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene is Cc1ccc(-c2cccc(-c3cc(C)ccc3-c3ccc(C)cc3)c2)cc1.
What is the InChIKey of 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene?
The InChIKey is HXJBILZADNONFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24/c1-19-7-12-22(13-8-19)24-5-4-6-25(18-24)27-17-21(3)11-16-26(27)23-14-9-20(2)10-15-23/h4-18H,1-3H3.
What are the key properties of 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene?
4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene has a molecular weight of 348.49 g/mol, XLogP of 7.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methylphenyl)-2-[3-(4-methylphenyl)phenyl]benzene is sourced from PubChem (CID 58892414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).