4-[2-Methoxy-5-methyl-4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazole-3-carboxylic acid

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Catalog Number
ACM21016002
Product Name
4-[2-Methoxy-5-methyl-4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazole-3-carboxylic acid
CAS
21016-00-2
Category
Heterocyclic Organic Compound
Synonyms
EINECS 244-146-5, CID89410, 21016-00-2, 4,5-Dihydro-4-((2-methoxy-5-methyl-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-carboxylic acid
IUPAC Name
4-[[2-methoxy-5-methyl-4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]-5-oxo-1-(4-sulfophenyl)-4H-pyrazole-3-carboxylic acid
Molecular Weight
620.587 g/mol
Molecular Formula
C20H20N4O13S3
Canonical SMILES
CC1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)O)OC)N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O
InChI Key
XWBRDSPQNJLYFS-UHFFFAOYSA-N
Density
1.76g/cm³
EC Number
244-146-5
Exact Mass
620.01900
H-Bond Acceptor
16
H-Bond Donor
3
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