Betaine 2-methyl-3-(3-sulfopropyl)benzothiazolium
CAS Registry Number®
56405-37-9
CAS Name
Betaine 2-methyl-3-(3-sulfopropyl)benzothiazoliumMolecular Formula
C11H13NO3S2Cite this Page
Betaine 2-methyl-3-(3-sulfopropyl)benzothiazolium. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=56405-37-9 (retrieved ) (CAS RN: 56405-37-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
266-268 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C11H13NO3S2/c1-9-12(7-4-8-17(13,14)15)10-5-2-3-6-11(10)16-9/h2-3,5-6H,4,7-8H2,1H3
InChIKey
InChIKey=XSEOLEIVLCYZQR-UHFFFAOYSA-N
SMILES
C(CCS(=O)(=O)[O-])[N+]=1C=2C(SC1C)=CC=CC2
Canonical SMILES
O=S(=O)([O-])CCC[N+]=1C=2C=CC=CC2SC1C
Other Names for this Substance
- Benzothiazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt
- Benzothiazolium, 2-methyl-3-(3-sulfopropyl)-, hydroxide, inner salt
- Betaine 2-methyl-3-(3-sulfopropyl)benzothiazolium
- 3-(3-Sulfopropyl)-2-methylbenzothiazolium, inner salt
- 2-Methyl-3-(3-sulfonatopropyl)-1,3-benzothiazol-3-ium
