2-Chloro-5-methylbenzoic acid
Properties
- Molecular formula
- C8H7ClO2
- Molar mass
- 170.59 g/mol
- Exact mass
- 170.0135 Da
- Melting point
- 207–208 °C
- logP
- 2.35Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H302 Harmful if swallowed84.8% of notifiers
- H315 Causes skin irritation15.2% of notifiers
- H318 Causes serious eye damage84.8% of notifiers
- H319 Causes serious eye irritation15.2% of notifiers
- H335 May cause respiratory irritation13% of notifiers
- H411 Toxic to aquatic life with long lasting effects84.8% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
6342-60-5SMILES
Cc1ccc(Cl)c(C(=O)O)c1InChIKey
LEBWXJZAWTVKFL-UHFFFAOYSA-NInChI
InChI=1S/C8H7ClO2/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Benzoic acid, 2-chloro-5-methyl-
- m-Toluic acid, 6-chloro-
- NSC 46623
Work with 2-Chloro-5-methylbenzoic acid
Similar compounds
4-Methylphthalic acid4316-23-868 % similar
2,5-Dichlorobenzoic acid50-79-366 % similar
2,5-Dimethylbenzoic acid610-72-064 % similar
2-Chloro-5-hydroxybenzoic acid56961-30-962 % similar
5-Methylsalicylic acid89-56-562 % similar
2,5-Dichloro-1,4-benzenedicarboxylic acid13799-90-160 % similar
2-Chloro-5-iodobenzoic acid19094-56-560 % similar
5-Bromo-2-chlorobenzoic acid21739-92-460 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.