3-Chloro-4-hydroxybenzoic acid

C7H5ClO3CAS 3964-58-7172.56 g/mol

OHOOHCl
Aryl halideCarboxylic acidPhenol

Properties

Molecular formula
C7H5ClO3
Molar mass
172.56 g/mol
Exact mass
171.9927 Da
Melting point
171 °C
logP
1.74Crippen estimate
Polar surface area
57.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
3964-58-7
SMILES
O=C(O)c1ccc(O)c(Cl)c1
InChIKey
QGNLHMKIGMZKJX-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)

Weigh it out

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

Names and synonyms

4 names
  • Benzoic acid, 3-chloro-4-hydroxy-
  • 4-Hydroxy-3-chlorobenzoic acid
  • m-Chloro-p-hydroxybenzoic acid
  • NSC 21186

Work with 3-Chloro-4-hydroxybenzoic acid

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere