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Structure

6-Methyl-2-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]-1,3-benzothiazole-7-sulfonic acid

CAS
5855-99-2
Catalog Number
ACM5855992
Category
Other Products
Molecular Weight
401.459 g/mol
Molecular Formula
C18H15N3O4S2

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Specification

Synonyms
CID79956, EINECS 227-472-2, 2-(4-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)phenyl)-6-methylbenzothiazole-7-sulphonic acid, 5855-99-2
IUPAC Name
6-methyl-2-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]-1,3-benzothiazole-7-sulfonic acid
Canonical SMILES
CC1=NN(C(=O)C1)C2=CC=C(C=C2)C3=NC4=C(S3)C(=C(C=C4)C)S(=O)(=O)O
InChI Key
IHXSKOQMJPMEFP-UHFFFAOYSA-N
Density
1.56g/cm³
EC Number
227-472-2
Exact Mass
401.05000
H-Bond Acceptor
6
H-Bond Donor
1
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