1-(4-phenylphenyl)ethanone

C14H12O — CID 7113

IUPAC1-(4-phenylphenyl)ethanone
SMILESCC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C14H12O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H3
InChIKeyQCZZSANNLWPGEA-UHFFFAOYSA-N
MW196.25 g/mol
LogP3.56
Rot. Bonds2

About 1-(4-phenylphenyl)ethanone

1-(4-phenylphenyl)ethanone (PubChem CID 7113) has the molecular formula C14H12O and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(4-phenylphenyl)ethanone.

Molecular Properties

Compound Name1-(4-phenylphenyl)ethanone
PubChem CID7113
Molecular FormulaC14H12O
Molecular Weight196.25 g/mol
Exact Mass196.09
IUPAC Name1-(4-phenylphenyl)ethanone
SMILESCC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C14H12O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H3
InChIKeyQCZZSANNLWPGEA-UHFFFAOYSA-N
XLogP3.56
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,4-Naphthoquinone
CID 8530
Benzophenone
CID 3102
Menadione
CID 4055
Acetophenone
CID 7410
Phylloquinone
CID 5284607
Anthraquinone
CID 6780
Vitamin K
CID 5280483
1,2-Naphthoquinone
CID 10667
Menatetrenone
CID 5282367
4-Methylbenzaldehyde
CID 7725
9,10-Phenanthrenedione
CID 6763
1-Phenyl-1-propanone
CID 7148

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylphenyl)ethanone?
The IUPAC name of 1-(4-phenylphenyl)ethanone (CID 7113) is 1-(4-phenylphenyl)ethanone.
What is the SMILES notation for 1-(4-phenylphenyl)ethanone?
The canonical SMILES for 1-(4-phenylphenyl)ethanone is CC(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-(4-phenylphenyl)ethanone?
The InChIKey is QCZZSANNLWPGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H3.
What are the key properties of 1-(4-phenylphenyl)ethanone?
1-(4-phenylphenyl)ethanone has a molecular weight of 196.25 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylphenyl)ethanone is sourced from PubChem (CID 7113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).