(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone

C16H16O2 — CID 13251027

IUPAC(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2cc(C)cc(C)c2O)cc1
InChIInChI=1S/C16H16O2/c1-10-4-6-13(7-5-10)16(18)14-9-11(2)8-12(3)15(14)17/h4-9,17H,1-3H3
InChIKeyADDPSLBZWVOKNU-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.55
Rot. Bonds2

About (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone

(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone (PubChem CID 13251027) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone.

Molecular Properties

Compound Name(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone
PubChem CID13251027
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2cc(C)cc(C)c2O)cc1
InChIInChI=1S/C16H16O2/c1-10-4-6-13(7-5-10)16(18)14-9-11(2)8-12(3)15(14)17/h4-9,17H,1-3H3
InChIKeyADDPSLBZWVOKNU-UHFFFAOYSA-N
XLogP3.55
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3,4-dihydroxy-5-methylphenyl)-(4-methylphenyl)methanone
CID 129087324
4-(3-benzoyl-4-hydroxy-5-methylphenyl)benzoic acid
CID 139839153
(E)-1-(2-hydroxy-3,5-dimethylphenyl)-3-(4-methylphenyl)prop-2-en-1-one
CID 7575127
(2-hydroxy-3,5-dimethylphenyl)-thiophen-2-ylmethanone
CID 13404184
(3-amino-5-fluoro-2,4-dihydroxyphenyl)-(4-methylphenyl)methanone
CID 88742758
(2-methylphenyl)-(4-methylphenyl)methanone
CID 6613295
[2,5-dichloro-4-(4-methylbenzoyl)phenyl]-(4-methylphenyl)methanone
CID 3101530
(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone
CID 12739979
(4-tert-butylphenyl)-(2,4-dimethylphenyl)methanone
CID 43337773
4-[(E)-3-(2-hydroxy-3,5-dimethylphenyl)-3-oxoprop-1-enyl]benzoic acid
CID 7212866
4-benzoyl-6-(4-methylbenzoyl)benzene-1,3-dicarboxylic acid
CID 23586588
2-benzoyl-5-(4-methylbenzoyl)terephthalic acid
CID 23586512

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone?
The IUPAC name of (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone (CID 13251027) is (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone.
What is the SMILES notation for (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone?
The canonical SMILES for (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone is Cc1ccc(C(=O)c2cc(C)cc(C)c2O)cc1.
What is the InChIKey of (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone?
The InChIKey is ADDPSLBZWVOKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-10-4-6-13(7-5-10)16(18)14-9-11(2)8-12(3)15(14)17/h4-9,17H,1-3H3.
What are the key properties of (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone?
(2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone has a molecular weight of 240.30 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-3,5-dimethylphenyl)-(4-methylphenyl)methanone is sourced from PubChem (CID 13251027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).