3-Hydroxybenzoic acid

C₇H₆O₃CAS 99-06-9138.12 g/mol

Open in Covalent MOL file

Carboxylic acid Phenol

Properties

Molecular formula: C₇H₆O₃
Molar mass: 138.12 g/mol
Exact mass: 138.0317 Da
Melting point: 202 °C
logP: 1.09Crippen estimate
Polar surface area: 57.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

99-06-9

SMILES

O=C(O)c1cccc(O)c1

InChIKey

IJFXRHURBJZNAO-UHFFFAOYSA-N

InChI

InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names

Benzoic acid, 3-hydroxy-
Benzoic acid, m-hydroxy-
m-Hydroxybenzoic acid
m-Salicylic acid
3-Carboxyphenol
m-Carboxyphenol
NSC 55746

Work with 3-Hydroxybenzoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Isophthalic acid121-91-572 % similar 5-Hydroxyisophthalic acid618-83-763 % similar 6-Hydroxy-2-naphthoic acid16712-64-461 % similar 3-Fluorobenzoic acid455-38-960 % similar 3-Chlorobenzoic acid535-80-860 % similar 3-Bromobenzoic acid585-76-260 % similar 3-Hydroxyacetophenone121-71-158 % similar 3,3′-Dithiobis[benzoic acid]1227-49-258 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,5-Dihydroxybenzaldehyde1194-98-5 Protocatechuic aldehyde139-85-5 2,3-Dihydroxybenzaldehyde24677-78-9 3,5-Dihydroxybenzaldehyde26153-38-8 2,6-Dihydroxybenzaldehyde387-46-2 3-Furanacrylic acid39244-10-5 Sesamol533-31-3 Furylacrylic acid539-47-9

Elsewhere

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