Benzothiazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner salt
CAS Registry Number®
65287-01-6
CAS Name
Benzothiazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner saltMolecular Formula
C12H15NO3S2Cite this Page
Benzothiazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=65287-01-6 (retrieved ) (CAS RN: 65287-01-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
272 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C12H15NO3S2/c1-9-4-5-12-11(8-9)13(10(2)17-12)6-3-7-18(14,15)16/h4-5,8H,3,6-7H2,1-2H3
InChIKey
InChIKey=RHVVCHULMIKELS-UHFFFAOYSA-N
SMILES
C(CCS(=O)(=O)[O-])[N+]=1C=2C(SC1C)=CC=C(C)C2
Canonical SMILES
O=S(=O)([O-])CCC[N+]=1C=2C=C(C=CC2SC1C)C
Other Names for this Substance
- Benzothiazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, inner salt
- Benzothiazolium, 2,5-dimethyl-3-(3-sulfopropyl)-, hydroxide, inner salt
- 2,5-Dimethyl-3-(3-sulfopropyl)benzothiazolium betaine
