phenyl-(2,4,6-triphenylphenyl)methanone

C31H22O — CID 3631606

IUPACphenyl-(2,4,6-triphenylphenyl)methanone
SMILESO=C(c1ccccc1)c1c(-c2ccccc2)cc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C31H22O/c32-31(26-19-11-4-12-20-26)30-28(24-15-7-2-8-16-24)21-27(23-13-5-1-6-14-23)22-29(30)25-17-9-3-10-18-25/h1-22H
InChIKeySMTQWBJOXUKBEI-UHFFFAOYSA-N
MW410.52 g/mol
LogP7.92
Rot. Bonds5

About phenyl-(2,4,6-triphenylphenyl)methanone

phenyl-(2,4,6-triphenylphenyl)methanone (PubChem CID 3631606) has the molecular formula C31H22O and a molecular weight of 410.52 g/mol. Its IUPAC name is phenyl-(2,4,6-triphenylphenyl)methanone.

Molecular Properties

Compound Namephenyl-(2,4,6-triphenylphenyl)methanone
PubChem CID3631606
Molecular FormulaC31H22O
Molecular Weight410.52 g/mol
Exact Mass410.17
IUPAC Namephenyl-(2,4,6-triphenylphenyl)methanone
SMILESO=C(c1ccccc1)c1c(-c2ccccc2)cc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C31H22O/c32-31(26-19-11-4-12-20-26)30-28(24-15-7-2-8-16-24)21-27(23-13-5-1-6-14-23)22-29(30)25-17-9-3-10-18-25/h1-22H
InChIKeySMTQWBJOXUKBEI-UHFFFAOYSA-N
XLogP7.92
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.52
LogP ≤ 57.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[2-methyl-6-(4-methylphenyl)-4-phenylphenyl]-phenylmethanone
CID 2825389
phenyl-(4-phenylphenyl)methanone
CID 155775877
(2-methyl-3,4,6-triphenylphenyl)-phenylmethanone
CID 13495520
diphenylphosphanyl-(2,4,6-triphenylphenyl)methanone
CID 141124682
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
CID 19009361
diphenylmethanone
CID 3102
2-(2-hydroxyphenyl)-1-(2,4,6-triphenylphenyl)ethanone
CID 175023207
4-(2,3,5-triphenylphenyl)benzoic acid
CID 101126682
diphenylphosphanyl 2,4,6-triphenylbenzoate
CID 164898462
bis[3-(3,5-diphenylphenyl)-5-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]methanone
CID 58299054
[3,5-bis[3-(3,5-diphenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone
CID 58299161
2-benzoyl-6-phenylbenzoic acid
CID 174388121

Frequently Asked Questions

What is the IUPAC name of phenyl-(2,4,6-triphenylphenyl)methanone?
The IUPAC name of phenyl-(2,4,6-triphenylphenyl)methanone (CID 3631606) is phenyl-(2,4,6-triphenylphenyl)methanone.
What is the SMILES notation for phenyl-(2,4,6-triphenylphenyl)methanone?
The canonical SMILES for phenyl-(2,4,6-triphenylphenyl)methanone is O=C(c1ccccc1)c1c(-c2ccccc2)cc(-c2ccccc2)cc1-c1ccccc1.
What is the InChIKey of phenyl-(2,4,6-triphenylphenyl)methanone?
The InChIKey is SMTQWBJOXUKBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H22O/c32-31(26-19-11-4-12-20-26)30-28(24-15-7-2-8-16-24)21-27(23-13-5-1-6-14-23)22-29(30)25-17-9-3-10-18-25/h1-22H.
What are the key properties of phenyl-(2,4,6-triphenylphenyl)methanone?
phenyl-(2,4,6-triphenylphenyl)methanone has a molecular weight of 410.52 g/mol, XLogP of 7.92, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(2,4,6-triphenylphenyl)methanone is sourced from PubChem (CID 3631606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).