1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone

C9H9FO3 — CID 84769280

IUPAC1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone
SMILESCOc1cc(O)cc(F)c1C(C)=O
InChIInChI=1S/C9H9FO3/c1-5(11)9-7(10)3-6(12)4-8(9)13-2/h3-4,12H,1-2H3
InChIKeyUHGWUQUKMSQKFC-UHFFFAOYSA-N
MW184.17 g/mol
LogP1.74
Rot. Bonds2

About 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone

1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone (PubChem CID 84769280) has the molecular formula C9H9FO3 and a molecular weight of 184.17 g/mol. Its IUPAC name is 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone.

Molecular Properties

Compound Name1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone
PubChem CID84769280
Molecular FormulaC9H9FO3
Molecular Weight184.17 g/mol
Exact Mass184.05
IUPAC Name1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone
SMILESCOc1cc(O)cc(F)c1C(C)=O
InChIInChI=1S/C9H9FO3/c1-5(11)9-7(10)3-6(12)4-8(9)13-2/h3-4,12H,1-2H3
InChIKeyUHGWUQUKMSQKFC-UHFFFAOYSA-N
XLogP1.74
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.17
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone 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

1-(4-amino-2-fluoro-6-methoxyphenyl)ethanone
CID 171018286
1-(4-fluoro-2,6-dimethoxyphenyl)ethanone
CID 117287701
3-fluoro-5-methoxy-4-methylphenol
CID 84650327
2-(2-fluoro-4-hydroxy-6-methoxyphenyl)propanoic acid
CID 84783347
1-(3-bromo-2-fluoro-4,6-dimethoxyphenyl)ethanone
CID 84811157
CID 158943354
CID 158943354
1-(3,4,6-trifluoro-2-hydroxyphenyl)ethanone
CID 164772496
1-(3-fluoro-6-methoxy-2-methylphenyl)ethanone
CID 84658391
4-hydroxy-2,6-dimethoxybenzohydrazide
CID 59092606
1-[2,6-dimethoxy-4-(trifluoromethyl)phenyl]ethanone
CID 84803559
1-(2-hydroxy-4,6-dimethoxy-3-methylsulfanylphenyl)ethanone
CID 121223856
2-fluoro-4-hydroxy-6-methoxybenzenesulfonyl chloride
CID 84800596

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone?
The IUPAC name of 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone (CID 84769280) is 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone.
What is the SMILES notation for 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone?
The canonical SMILES for 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone is COc1cc(O)cc(F)c1C(C)=O.
What is the InChIKey of 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone?
The InChIKey is UHGWUQUKMSQKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FO3/c1-5(11)9-7(10)3-6(12)4-8(9)13-2/h3-4,12H,1-2H3.
What are the key properties of 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone?
1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone has a molecular weight of 184.17 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4-hydroxy-6-methoxyphenyl)ethanone is sourced from PubChem (CID 84769280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).