2,4-Dimethylbenzenesulfonic acid
Properties
- Molecular formula
- C8H10O3S
- Molar mass
- 186.23 g/mol
- Exact mass
- 186.0351 Da
- Melting point
- 61–62 °C
- logP
- 1.55Crippen estimate
- Polar surface area
- 54.4 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364
Identifiers
CAS number
88-61-9SMILES
Cc1ccc(S(=O)(=O)O)c(C)c1InChIKey
CHZLVSBMXZSPNN-UHFFFAOYSA-NInChI
InChI=1S/C8H10O3S/c1-6-3-4-8(7(2)5-6)12(9,10)11/h3-5H,1-2H3,(H,9,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Benzenesulfonic acid, 2,4-dimethyl-
- 2,4-Xylenesulfonic acid
- m-Xylenesulfonic acid
- m-Xylene-4-sulfonic acid
- SXA 60
- 2,4-Dimethylbenzene-1-sulfonic acid
Work with 2,4-Dimethylbenzenesulfonic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
2-Amino-5-methylbenzenesulfonic acid88-44-859 % similar
2,4,6-Trimethylbenzenesulfonic acid3453-83-658 % similar
2,4-Dimethylbenzenesulfonyl chloride609-60-958 % similar
2-Amino-3,5-dimethylbenzenesulfonic acid88-22-257 % similar
Policresulen101418-00-257 % similar
p-Toluenesulfonic acid104-15-452 % similar
5-Amino-2-methylbenzenesulfonic acid118-88-750 % similar
2-Amino-4,5-dimethylbenzenesulfonic acid56375-83-849 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds