5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid

C14H10ClFO4 — CID 91687279

IUPAC5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid
SMILESO=C(O)c1cc(Cl)c(OCc2ccccc2F)cc1O
InChIInChI=1S/C14H10ClFO4/c15-10-5-9(14(18)19)12(17)6-13(10)20-7-8-3-1-2-4-11(8)16/h1-6,17H,7H2,(H,18,19)
InChIKeyBURGBMHOMQMSAW-UHFFFAOYSA-N
MW296.68 g/mol
LogP3.46
Rot. Bonds4

About 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid

5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid (PubChem CID 91687279) has the molecular formula C14H10ClFO4 and a molecular weight of 296.68 g/mol. Its IUPAC name is 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid.

Molecular Properties

Compound Name5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid
PubChem CID91687279
Molecular FormulaC14H10ClFO4
Molecular Weight296.68 g/mol
Exact Mass296.03
IUPAC Name5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid
SMILESO=C(O)c1cc(Cl)c(OCc2ccccc2F)cc1O
InChIInChI=1S/C14H10ClFO4/c15-10-5-9(14(18)19)12(17)6-13(10)20-7-8-3-1-2-4-11(8)16/h1-6,17H,7H2,(H,18,19)
InChIKeyBURGBMHOMQMSAW-UHFFFAOYSA-N
XLogP3.46
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.68
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid 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

4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid
CID 91682681
2-[(2-fluorophenyl)methoxy]benzoic acid
CID 8707038
4-[(2-chlorophenyl)methoxy]-2-hydroxybenzoic acid
CID 91679064
3-chloro-4-[(2-fluorophenyl)methoxy]-5-methoxybenzoic acid
CID 8707053
2-chloro-6-[(2-fluorophenyl)methoxy]pyridine-4-carboxylic acid
CID 63932215
2-[(2,4-difluorophenyl)methoxy]benzoic acid
CID 62198104
2-bromo-4-chloro-1-[(2-fluorophenyl)methoxy]benzene
CID 146003855
3,5-dibromo-4-[(2-fluorophenyl)methoxy]benzoic acid
CID 8707072
2-[(2-chlorophenoxy)methyl]-5-hydroxybenzoic acid
CID 117221100
4-[(2,4-dichlorophenyl)methoxy]-2-hydroxy-5-nitrobenzoic acid
CID 91687263
3-chloro-4-[(2-fluorophenyl)methoxy]benzenecarbothioamide
CID 61389088
3-[(2-bromo-4-chlorophenoxy)methyl]-2-fluorobenzoic acid
CID 107119677

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid?
The IUPAC name of 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid (CID 91687279) is 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid.
What is the SMILES notation for 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid?
The canonical SMILES for 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid is O=C(O)c1cc(Cl)c(OCc2ccccc2F)cc1O.
What is the InChIKey of 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid?
The InChIKey is BURGBMHOMQMSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFO4/c15-10-5-9(14(18)19)12(17)6-13(10)20-7-8-3-1-2-4-11(8)16/h1-6,17H,7H2,(H,18,19).
What are the key properties of 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid?
5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid has a molecular weight of 296.68 g/mol, XLogP of 3.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-[(2-fluorophenyl)methoxy]-2-hydroxybenzoic acid is sourced from PubChem (CID 91687279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).