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

C16H16O2 — CID 22951592

IUPAC(2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccc(C)cc2O)c(C)c1
InChIInChI=1S/C16H16O2/c1-10-4-6-13(12(3)8-10)16(18)14-7-5-11(2)9-15(14)17/h4-9,17H,1-3H3
InChIKeyWWLKHGAXRVNXMB-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.55
Rot. Bonds2

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

(2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone (PubChem CID 22951592) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone
PubChem CID22951592
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name(2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2ccc(C)cc2O)c(C)c1
InChIInChI=1S/C16H16O2/c1-10-4-6-13(12(3)8-10)16(18)14-7-5-11(2)9-15(14)17/h4-9,17H,1-3H3
InChIKeyWWLKHGAXRVNXMB-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

(2,4-dimethylphenyl)-(2,3,4-trimethylphenyl)methanone
CID 70628642
ethane;2-hydroxy-4-methylbenzoic acid
CID 145280120
2-hydroxy-1-(2-hydroxy-4-methylphenyl)ethanone
CID 68538226
(2,4-dimethylbenzoyl)-oxophosphanium
CID 151738944
(3-tert-butyl-4-hydroxyphenyl)-(2,4-dimethylphenyl)methanone
CID 86189379
(4-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
CID 43160123
(2-hydroxy-4-sulfanylphenyl)-(4-methyl-2-sulfanylphenyl)methanone
CID 144572641
(4-tert-butylphenyl)-(2,4-dimethylphenyl)methanone
CID 43337773
(4-chloronaphthalen-1-yl)-(2,4-dimethylphenyl)methanone
CID 79591122
[3-(2,4-dimethylbenzoyl)-4-phosphorosophenyl]-(2,4-dimethylphenyl)methanone
CID 140523804
amino 2-hydroxy-4-methylbenzoate
CID 174368722
(2,4-dimethylphenyl)-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanone
CID 63927682

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone?
The IUPAC name of (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone (CID 22951592) is (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone.
What is the SMILES notation for (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone?
The canonical SMILES for (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone is Cc1ccc(C(=O)c2ccc(C)cc2O)c(C)c1.
What is the InChIKey of (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone?
The InChIKey is WWLKHGAXRVNXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-10-4-6-13(12(3)8-10)16(18)14-7-5-11(2)9-15(14)17/h4-9,17H,1-3H3.
What are the key properties of (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone?
(2,4-dimethylphenyl)-(2-hydroxy-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 (2,4-dimethylphenyl)-(2-hydroxy-4-methylphenyl)methanone is sourced from PubChem (CID 22951592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).