[4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone

C15H14O3 — CID 71390287

IUPAC[4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone
SMILESCc1cccc(C(=O)c2ccc(O)c(CO)c2)c1
InChIInChI=1S/C15H14O3/c1-10-3-2-4-11(7-10)15(18)12-5-6-14(17)13(8-12)9-16/h2-8,16-17H,9H2,1H3
InChIKeyAFFFSNJASGMADB-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.42
Rot. Bonds3

About [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone

[4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone (PubChem CID 71390287) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone.

Molecular Properties

Compound Name[4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone
PubChem CID71390287
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name[4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone
SMILESCc1cccc(C(=O)c2ccc(O)c(CO)c2)c1
InChIInChI=1S/C15H14O3/c1-10-3-2-4-11(7-10)15(18)12-5-6-14(17)13(8-12)9-16/h2-8,16-17H,9H2,1H3
InChIKeyAFFFSNJASGMADB-UHFFFAOYSA-N
XLogP2.42
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

bis(3-methylphenyl)methanone
CID 17848
(4-hydroxyphenyl)-(3-methylphenyl)methanone
CID 22132621
N-[2-hydroxy-5-[4-hydroxy-3-[(3-methylbenzoyl)amino]benzoyl]phenyl]-3-methylbenzamide
CID 139492461
(3-methylphenyl)-[4-[(4-methylphenyl)methyl]phenyl]methanone
CID 54157138
(3-methylphenyl)-naphthalen-2-ylmethanone
CID 15552635
2-(hydroxymethyl)-4-[(3-methylphenyl)diazenyl]phenol
CID 136794286
bis[4-hydroxy-3-(2-methylprop-2-enyl)phenyl]methanone
CID 139631724
(4-chloro-3-methylphenyl)-(3-methylphenyl)methanone
CID 112694024
3-(5-benzoyl-2-hydroxyphenyl)propanoic acid
CID 14089152
(4-dichlorophosphorylphenyl)-(3-methylphenyl)methanone
CID 141016021
(3-methylphenyl)-(4-methylsulfonylphenyl)methanone
CID 21262973
(3-methylphenyl)-[4-(10-phenylanthracen-9-yl)phenyl]methanone
CID 87107427

Frequently Asked Questions

What is the IUPAC name of [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone?
The IUPAC name of [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone (CID 71390287) is [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone.
What is the SMILES notation for [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone?
The canonical SMILES for [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone is Cc1cccc(C(=O)c2ccc(O)c(CO)c2)c1.
What is the InChIKey of [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone?
The InChIKey is AFFFSNJASGMADB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-10-3-2-4-11(7-10)15(18)12-5-6-14(17)13(8-12)9-16/h2-8,16-17H,9H2,1H3.
What are the key properties of [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone?
[4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone has a molecular weight of 242.27 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-hydroxy-3-(hydroxymethyl)phenyl]-(3-methylphenyl)methanone is sourced from PubChem (CID 71390287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).