1-amino-4-(4-ethenylsulfonylanilino)-9,10-dioxoanthracene-2-sulfonic acid

CAS: 62669-67-4

Molecular Formula	`C22H16N2O7S2`
Molecular Weight	484.5 g/mol
LogP	3.3
Topological Polar Surface Area	177.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	9
Rotatable Bonds	5
Exact Mass	484.0399
Heavy Atoms	33
Complexity	1010.0

Chemical Identifiers

CAS Number	62669-67-4
SMILES	`C=CS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O`
InChIKey	`NHVANJGFAFQZEE-UHFFFAOYSA-N`

📖 Product Overview

1-amino-4-(4-ethenylsulfonylanilino)-9,10-dioxoanthracene-2-sulfonic acid (CAS: 62669-67-4) is a chemical compound with molecular formula C22H16N2O7S2 and molecular weight 484.5 g/mol. Its IUPAC systematic name is 1-amino-4-(4-ethenylsulfonylanilino)-9,10-dioxoanthracene-2-sulfonic acid. LogP 3.3 Topological Polar Surface Area 177.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 9 Rotatable Bonds 5 Exact Mass 484.0399 Heavy Atoms 33 Complexity 1010.0 InChI Key: NHVANJGFAFQZEE-UHFFFAOYSA-N. SMILES: C=CS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.

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