CAS
94247-95-7 Purity
96%
94247-95-7 Purity
96%
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2-(3-Heptadecyl-4,5-dihydro-5-oxo-1H-pyrazol-1-yl)benzothiazolesulfonic acid
CAS
94247-98-0
Catalog Number
ACM94247980
Category
Other Products
Molecular Weight
537.778020 [g/mol]
Molecular Formula
C27H41N3O4S2
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Specification
Synonyms
CTK3I7803, AG-H-88865, Benzothiazolesulfonicacid, 2-(3-heptadecyl-4,5-dihydro-5-oxo-1H-pyrazol-1-yl)- (9CI), 94247-98-0
IUPAC Name
2-(3-heptadecyl-5-oxo-4H-pyrazol-1-yl)-3H-1,3-benzothiazole-2-sulfonic acid
Canonical SMILES
CCCCCCCCCCCCCCCCCC1=NN(C(=O)C1)C2(NC3=CC=CC=C3S2)S(=O)(=O)O
InChI Key
RXBHAYGECQKZPL-UHFFFAOYSA-N
Density
1.24g/cm³
EC Number
304-268-2
Exact Mass
537.26900
H-Bond Acceptor
7
H-Bond Donor
2
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