1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene

C37H28 — CID 123283333

IUPAC1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
SMILESCc1cccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)c1
InChIInChI=1S/C37H28/c1-27-12-11-19-31(20-27)35-22-34(30-17-9-4-10-18-30)25-37(26-35)36-23-32(28-13-5-2-6-14-28)21-33(24-36)29-15-7-3-8-16-29/h2-26H,1H3
InChIKeyMHRHYLZJNCPXAH-UHFFFAOYSA-N
MW472.63 g/mol
LogP10.33
Rot. Bonds5

About 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene

1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene (PubChem CID 123283333) has the molecular formula C37H28 and a molecular weight of 472.63 g/mol. Its IUPAC name is 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene.

Molecular Properties

Compound Name1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
PubChem CID123283333
Molecular FormulaC37H28
Molecular Weight472.63 g/mol
Exact Mass472.22
IUPAC Name1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
SMILESCc1cccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)c1
InChIInChI=1S/C37H28/c1-27-12-11-19-31(20-27)35-22-34(30-17-9-4-10-18-30)25-37(26-35)36-23-32(28-13-5-2-6-14-28)21-33(24-36)29-15-7-3-8-16-29/h2-26H,1H3
InChIKeyMHRHYLZJNCPXAH-UHFFFAOYSA-N
XLogP10.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.63
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3-methylphenyl)-3-phenyl-5-(3-phenylphenyl)benzene
CID 123280286
1,3-dimethyl-5-[3-[3-[3-(3-methylphenyl)-5-phenylphenyl]phenyl]-5-phenylphenyl]benzene
CID 59552812
ethane;1-methyl-3-(3-phenylphenyl)benzene
CID 163289488
1-methyl-3-[3-[3-(4-phenylphenyl)phenyl]phenyl]benzene
CID 153438411
ethane;1-methyl-3-phenylbenzene
CID 142040878
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
methanamine;1-methyl-3-phenylbenzene
CID 145414985
ethane;methane;1-methyl-3-phenylbenzene
CID 144644852
ethane;1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 142439051
ethene;1-methyl-3-phenylbenzene
CID 142622149
1,3-dimethyl-5-(3-phenylphenyl)benzene;sulfane
CID 174481520
1,3-dimethyl-5-[3-methyl-5-[3-methyl-5-(3-methylphenyl)phenyl]phenyl]benzene
CID 140856009

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene?
The IUPAC name of 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene (CID 123283333) is 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene.
What is the SMILES notation for 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene?
The canonical SMILES for 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene is Cc1cccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)c1.
What is the InChIKey of 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene?
The InChIKey is MHRHYLZJNCPXAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H28/c1-27-12-11-19-31(20-27)35-22-34(30-17-9-4-10-18-30)25-37(26-35)36-23-32(28-13-5-2-6-14-28)21-33(24-36)29-15-7-3-8-16-29/h2-26H,1H3.
What are the key properties of 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene?
1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene has a molecular weight of 472.63 g/mol, XLogP of 10.33, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene is sourced from PubChem (CID 123283333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).