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Structure

5,6-Dichloro-1-ethyl-2-methyl-3-(3-sulfobutyl)benzimidazolium inner salt

CAS
63175-96-2
Catalog Number
ACM63175962
Category
Other Products
Molecular Weight
365.27
Molecular Formula
C14H18Cl2N2O3S

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Specification

Synonyms
MolPort-001-961-635, BAS 01317891, EINECS 263-982-1, CID113112, 5,6-Dichloro-1-ethyl-2-methyl-3-(3-sulphonatobutyl)-1H-benzimidazolium, 1H-Benzimidazolium, 5,6-dichloro-1-ethyl-2-methyl-3-(3-sulfobutyl)-, hydroxide, inner salt, 1H-Benzimidazolium, 5,6-dichloro-1-ethyl-2-methyl-3-(3-sulfobutyl)-, inner salt, 63175-96-2
IUPAC Name
4-(5,6-dichloro-3-ethyl-2-methylbenzimidazol-1-ium-1-yl)butane-2-sulfonate
Canonical SMILES
CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCC(C)S(=O)(=O)[O-])C
InChI Key
RMGCGNFGAHQWEQ-UHFFFAOYSA-N
Melting Point
310-315ºC
EC Number
263-982-1
Exact Mass
364.04200
H-Bond Acceptor
3
H-Bond Donor
0
Physical Description
5,6-Dichloro-1-ethyl-2-methyl-3-(3-sulfobutyl)benzimidazolium inner salt 98% (5g)
Safety Description
S24/25
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