Benzothiazolium,2-(methylthio)-3-(3-sulfopropyl)-,inner salt

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Catalog Number
ACM63149053
Product Name
Benzothiazolium,2-(methylthio)-3-(3-sulfopropyl)-,inner salt
Structure
Structure
CAS
63149-05-3
Category
Heterocyclic Organic Compound
Synonyms
2-METHYLTHIO-3-SULFOPROPYL-BENZOTHIAZOLE-BETAINE;benzothiazolium,2-(methylthio)-3-(3-sulfopropyl)-,hydroxide,innersalt;2-(methylthio)-3-(3-sulphonatopropyl)benzothiazolium;2-METHYLTHIO-3-(3-SULFOPROPYL)BENZOTHIAZOLIUM BETAINE;3-[[2-(Methylthio)benzothiaz
IUPAC Name
3-(2-methylsulfanyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate
Molecular Weight
303.42
Molecular Formula
C11H13NO3S3
Canonical SMILES
CSC1=[N+](C2=CC=CC=C2S1)CCCS(=O)(=O)[O-]
InChI Key
RREMLVIQMMQLLV-UHFFFAOYSA-N
Melting Point
243 - 247ºC
Density
g/cm³
Appearance
Light-yellow crystalline powder
EC Number
263-953-3
Exact Mass
303.00600
H-Bond Acceptor
3
H-Bond Donor
0
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