1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone

C15H14O2 — CID 53218902

IUPAC1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone
SMILESCC(=O)c1cccc(-c2cc(C)cc(O)c2)c1
InChIInChI=1S/C15H14O2/c1-10-6-14(9-15(17)7-10)13-5-3-4-12(8-13)11(2)16/h3-9,17H,1-2H3
InChIKeyIZHDHZGRIHFQTR-UHFFFAOYSA-N
MW226.27 g/mol
LogP3.57
Rot. Bonds2

About 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone

1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone (PubChem CID 53218902) has the molecular formula C15H14O2 and a molecular weight of 226.27 g/mol. Its IUPAC name is 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone.

Molecular Properties

Compound Name1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone
PubChem CID53218902
Molecular FormulaC15H14O2
Molecular Weight226.27 g/mol
Exact Mass226.10
IUPAC Name1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone
SMILESCC(=O)c1cccc(-c2cc(C)cc(O)c2)c1
InChIInChI=1S/C15H14O2/c1-10-6-14(9-15(17)7-10)13-5-3-4-12(8-13)11(2)16/h3-9,17H,1-2H3
InChIKeyIZHDHZGRIHFQTR-UHFFFAOYSA-N
XLogP3.57
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[3-(3-carboxyphenyl)-5-methylphenyl]benzoic acid
CID 163197733
1-[3-(4-fluoro-3-hydroxyphenyl)phenyl]ethanone
CID 53219389
1-[3-(3-chlorophenyl)phenyl]ethanone
CID 4304570
3-(3-methoxyphenyl)-5-methylphenol
CID 53218837
1-[3-(3,5-dimethylphenyl)phenyl]propan-1-one
CID 54912702
4-(3-hydroxy-5-methylphenyl)benzoic acid
CID 53218919
3-(3-hydroxy-5-methylphenyl)benzonitrile
CID 53218798
1-[3-(2-methyl-3H-pyrrol-4-yl)phenyl]ethanone
CID 167579278
1-azulen-2-ylethanone
CID 15255141
ethane;methane;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene;1-phenylethanone
CID 160788394
1-[3-(2-fluoro-5-methylphenyl)phenyl]ethanone
CID 54912743
1-[3-[3-(hydroxymethyl)-4-methylphenyl]phenyl]ethanone
CID 144853232

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone?
The IUPAC name of 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone (CID 53218902) is 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone.
What is the SMILES notation for 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone?
The canonical SMILES for 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone is CC(=O)c1cccc(-c2cc(C)cc(O)c2)c1.
What is the InChIKey of 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone?
The InChIKey is IZHDHZGRIHFQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-10-6-14(9-15(17)7-10)13-5-3-4-12(8-13)11(2)16/h3-9,17H,1-2H3.
What are the key properties of 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone?
1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone has a molecular weight of 226.27 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone is sourced from PubChem (CID 53218902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).