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Home > Product > Heterocyclic Organic Compounds > Benzothiazolium,2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-5-chloro-3-(3-sulfopropyl)-,inner salt

Benzothiazolium,2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-5-chloro-3-(3-sulfopropyl)-,inner salt | CAS Number: 94232-70-9

Catalog Number
ACM94232709
Product Name
Benzothiazolium,2-[2-[[3-(2-carboxyethyl)-5-chloro-2(3H)-benzothiazolylidene]methyl]-1-buten-1-yl]-5-chloro-3-(3-sulfopropyl)-,inner salt
Structure
CAS Number
94232-70-9
EC Number
303-998-9
IUPAC Name
3-[2-[(Z)-2-[(E)-[3-(2-carboxyethyl)-5-chloro-1,3-benzothiazol-2-ylidene]methyl]but-1-enyl]-5-chloro-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
Synonyms
EINECS 303-998-9, 2-(2-((3-(2-Carboxyethyl)-5-chloro-3H-benzothiazol-2-ylidene)methyl)but-1-enyl)-5-chloro-3-(3-sulphonatopropyl)benzothiazolium, 94232-70-9
Molecular Weight
599.56946
Exact Mass
598.02200
Molecular Formula
C25H24Cl2N2O5S3
Density
g/cm3
Purity
96%
SMILES
CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCCS(=O)(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)Cl)CCC(=O)O
InChIKey
UPMBCOCBOLASHO-UHFFFAOYSA-N
H-Bond Donor
1
H-Bond Acceptor
6
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Tel:1-201-478-8534
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Address: Suite 212, Waverly Plaza, 755 Waverly Avenue, Holtsville, NY 11742, USA