5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol

C9H11ClO3 — CID 117291172

IUPAC5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol
SMILESCOc1cc(CCO)c(O)cc1Cl
InChIInChI=1S/C9H11ClO3/c1-13-9-4-6(2-3-11)8(12)5-7(9)10/h4-5,11-12H,2-3H2,1H3
InChIKeyRQKFLAQTMQNGPK-UHFFFAOYSA-N
MW202.64 g/mol
LogP1.59
Rot. Bonds3

About 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol

5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol (PubChem CID 117291172) has the molecular formula C9H11ClO3 and a molecular weight of 202.64 g/mol. Its IUPAC name is 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol.

Molecular Properties

Compound Name5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol
PubChem CID117291172
Molecular FormulaC9H11ClO3
Molecular Weight202.64 g/mol
Exact Mass202.04
IUPAC Name5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol
SMILESCOc1cc(CCO)c(O)cc1Cl
InChIInChI=1S/C9H11ClO3/c1-13-9-4-6(2-3-11)8(12)5-7(9)10/h4-5,11-12H,2-3H2,1H3
InChIKeyRQKFLAQTMQNGPK-UHFFFAOYSA-N
XLogP1.59
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.64
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol 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

2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol
CID 117306101
5-chloro-4-(3-hydroxypropyl)-2-methoxyphenol
CID 117308657
3-(5-chloro-2-hydroxy-4-methoxyphenyl)propanal
CID 117305887
5-chloro-4-methoxy-2-(2-piperazin-1-ylethyl)phenol
CID 117430083
5-chloro-2-fluoro-4-methoxyphenol
CID 84655771
5-chloro-4-(chloromethyl)-2-methoxyphenol
CID 131191143
3-[5-chloro-4-methoxy-2-(methoxymethyl)phenyl]propan-1-ol
CID 117363855
methyl 4-hydroxy-5-(2-hydroxyethyl)-2-methoxybenzoate
CID 117325036
4-chloro-2-fluoro-5-methoxyphenol
CID 91801475
2-bromo-5-chloro-4-methoxyphenol
CID 84700319
(2-amino-4-chloro-5-methoxyphenyl)methanol
CID 130139409
(5-chloro-2-ethyl-4-methoxyphenyl)methanol
CID 84669748

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol?
The IUPAC name of 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol (CID 117291172) is 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol.
What is the SMILES notation for 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol?
The canonical SMILES for 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol is COc1cc(CCO)c(O)cc1Cl.
What is the InChIKey of 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol?
The InChIKey is RQKFLAQTMQNGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClO3/c1-13-9-4-6(2-3-11)8(12)5-7(9)10/h4-5,11-12H,2-3H2,1H3.
What are the key properties of 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol?
5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol has a molecular weight of 202.64 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol is sourced from PubChem (CID 117291172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).