Benzenesulfonic acid, 2,4,6-trimethyl-, hydrate (1:1)
CAS Registry Number®
79326-99-1
CAS Name
Benzenesulfonic acid, 2,4,6-trimethyl-, hydrate (1:1)Molecular Formula
C9H12O3S.H2OCite this Page
Benzenesulfonic acid, 2,4,6-trimethyl-, hydrate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=79326-99-1 (retrieved ) (CAS RN: 79326-99-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C9H12O3S.H2O/c1-6-4-7(2)9(8(3)5-6)13(10,11)12;/h4-5H,1-3H3,(H,10,11,12);1H2
InChIKey
InChIKey=XNOZTDZTNOUJFT-UHFFFAOYSA-N
SMILES
S(=O)(=O)(O)C1=C(C)C=C(C)C=C1C.O
Canonical SMILES
O=S(=O)(O)C=1C(=CC(=CC1C)C)C.O
Other Names for this Substance
- Benzenesulfonic acid, 2,4,6-trimethyl-, hydrate (1:1)
- Benzenesulfonic acid, 2,4,6-trimethyl-, monohydrate
- Mesitylenesulfonic acid monohydrate