(2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone

C14H11ClO3 — CID 21459016

IUPAC(2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone
SMILESCOc1cc(C(=O)c2ccccc2Cl)ccc1O
InChIInChI=1S/C14H11ClO3/c1-18-13-8-9(6-7-12(13)16)14(17)10-4-2-3-5-11(10)15/h2-8,16H,1H3
InChIKeyKLGCOEJEEJLQCE-UHFFFAOYSA-N
MW262.69 g/mol
LogP3.29
Rot. Bonds3

About (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone

(2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone (PubChem CID 21459016) has the molecular formula C14H11ClO3 and a molecular weight of 262.69 g/mol. Its IUPAC name is (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone
PubChem CID21459016
Molecular FormulaC14H11ClO3
Molecular Weight262.69 g/mol
Exact Mass262.04
IUPAC Name(2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone
SMILESCOc1cc(C(=O)c2ccccc2Cl)ccc1O
InChIInChI=1S/C14H11ClO3/c1-18-13-8-9(6-7-12(13)16)14(17)10-4-2-3-5-11(10)15/h2-8,16H,1H3
InChIKeyKLGCOEJEEJLQCE-UHFFFAOYSA-N
XLogP3.29
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.69
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone
CID 21459023
(3-hydroxy-4-methoxyphenyl)-(2-hydroxyphenyl)methanone
CID 59116114
(2-chlorophenyl)-(6-methoxynaphthalen-2-yl)methanone
CID 63491320
(4-chloro-3-methoxyphenyl)-(2-methylsulfanylphenyl)methanone
CID 115781785
benzoic acid;4-hydroxy-3-methoxybenzoic acid
CID 159798679
(2-chlorophenyl)-(3,5-dimethoxyphenyl)methanone
CID 24723148
1,3-bis(4-hydroxy-3-methoxyphenyl)propane-1,3-dione
CID 143339753
(2-methoxycarbonylphenyl) 4-hydroxy-3-methoxybenzoate
CID 59397478
1-[2-(3,4-dimethoxybenzoyl)phenyl]ethanone
CID 102341182
4-hydroxy-3-methoxybenzoic acid;hydrate
CID 118665847
2-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl chloride
CID 175204394
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 623894

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone?
The IUPAC name of (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone (CID 21459016) is (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone?
The canonical SMILES for (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone is COc1cc(C(=O)c2ccccc2Cl)ccc1O.
What is the InChIKey of (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone?
The InChIKey is KLGCOEJEEJLQCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClO3/c1-18-13-8-9(6-7-12(13)16)14(17)10-4-2-3-5-11(10)15/h2-8,16H,1H3.
What are the key properties of (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone?
(2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone has a molecular weight of 262.69 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(4-hydroxy-3-methoxyphenyl)methanone is sourced from PubChem (CID 21459016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).