(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone

C14H11ClO2 — CID 86254780

IUPAC(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone
SMILESCc1cc(O)ccc1C(=O)c1ccccc1Cl
InChIInChI=1S/C14H11ClO2/c1-9-8-10(16)6-7-11(9)14(17)12-4-2-3-5-13(12)15/h2-8,16H,1H3
InChIKeyLXKOBTYWVSXRCV-UHFFFAOYSA-N
MW246.69 g/mol
LogP3.59
Rot. Bonds2

About (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone

(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone (PubChem CID 86254780) has the molecular formula C14H11ClO2 and a molecular weight of 246.69 g/mol. Its IUPAC name is (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone
PubChem CID86254780
Molecular FormulaC14H11ClO2
Molecular Weight246.69 g/mol
Exact Mass246.04
IUPAC Name(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone
SMILESCc1cc(O)ccc1C(=O)c1ccccc1Cl
InChIInChI=1S/C14H11ClO2/c1-9-8-10(16)6-7-11(9)14(17)12-4-2-3-5-13(12)15/h2-8,16H,1H3
InChIKeyLXKOBTYWVSXRCV-UHFFFAOYSA-N
XLogP3.59
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.69
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-2-methylbenzoyl chloride
CID 103689413
2-chloro-N-(4-hydroxy-2,6-dimethylphenyl)benzamide
CID 706333
N-[(2-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide
CID 103863466
N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
CID 103865613
[2-(dimethylamino)phenyl]-(4-hydroxy-2-methylphenyl)methanone;propanal
CID 163239741
(5-bromo-2-methylphenyl)-(2-chlorophenyl)methanone
CID 114963344
(2-chlorophenyl)-(2-fluoro-4-methylphenyl)methanone
CID 114963346
(3-chloro-2-fluorophenyl)-(2,4-dimethylphenyl)methanone
CID 64712749
[4-(2-chlorobenzoyl)-3,5-dimethylphenyl]-(2-chlorophenyl)methanone
CID 25138990
(2-chloro-4-methylsulfonylphenyl)-(2-methylphenyl)methanone
CID 174297294
benzene-1,4-diol;4-hydroxy-2-methylbenzoic acid
CID 67940861
benzene-1,2-diol;4-chloro-3-methylphenol
CID 67381878

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone?
The IUPAC name of (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone (CID 86254780) is (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone?
The canonical SMILES for (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone is Cc1cc(O)ccc1C(=O)c1ccccc1Cl.
What is the InChIKey of (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone?
The InChIKey is LXKOBTYWVSXRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClO2/c1-9-8-10(16)6-7-11(9)14(17)12-4-2-3-5-13(12)15/h2-8,16H,1H3.
What are the key properties of (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone?
(2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone has a molecular weight of 246.69 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(4-hydroxy-2-methylphenyl)methanone is sourced from PubChem (CID 86254780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).