Compound C24H16N4O11S3

2-[4-[2-(4-nitro-2-sulfophenyl)ethenyl]-3-sulfophenyl]benzo[e]benzotriazole-5-sulfonic acid

CAS: 131-43-1

Molecular Formula	`C24H16N4O11S3`
Molecular Weight	632.6 g/mol
LogP	2.9
Topological Polar Surface Area	265.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	13
Rotatable Bonds	6
Exact Mass	631.99774
Heavy Atoms	42
Complexity	1370.0

Chemical Identifiers

CAS Number	131-43-1
SMILES	`C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O`
InChIKey	`ZUALTTRSCLAGBQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C24H16N4O11S3 (CAS: 131-43-1) is a chemical compound with molecular formula C24H16N4O11S3 and molecular weight 632.6 g/mol. Its IUPAC systematic name is 2-[4-[2-(4-nitro-2-sulfophenyl)ethenyl]-3-sulfophenyl]benzo[e]benzotriazole-5-sulfonic acid. LogP 2.9 Topological Polar Surface Area 265.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 13 Rotatable Bonds 6 Exact Mass 631.99774 Heavy Atoms 42 Complexity 1370.0 InChI Key: ZUALTTRSCLAGBQ-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.

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