AC1NX4QA structure

AC1NX4QA

2-[[3-[(2-anilinonaphthalen-1-yl)diazenyl]-4-hydroxyphenyl]sulfonylamino]benzoic acid

Also Known As: EINECS 279-295-5|2-[[[4-hydroxy-3-[[2-(phenylamino)-1-naphthyl]azo]phenyl]sulphonyl]amino]benzoic acid|2-(((4-Hydroxy-3-((2-(phenylamino)-1-naphthyl)azo)phenyl)sulphonyl)amino)benzoic acid|2-[[[4-Hydroxy-3-[[2-(phenylamino)-1-naphthyl]azo]phenyl]sulfonyl]amino]benzoic acid|2-[[(3Z)-3-[(2-anilinonaphthalen-1-yl)hydrazinylidene]-4-oxocyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid|2-[[[4-hydroxy-3-[[2- -1-naphthyl]azo]phenyl]sulphonyl]amino]benzoicacid|2-({3-[(2-Anilinonaphthalen-1-yl)diazenyl]-4-hydroxybenzene-1-sulfonyl}amino)benzoic acid|2-(4-HYDROXY-3-{2-[2-(PHENYLAMINO)NAPHTHALEN-1-YL]DIAZEN-1-YL}BENZENESULFONAMIDO)BENZOIC ACID|2-[[(3E)-3-[(2-anilinonaphthalen-1-yl)hydrazinylidene]-4-oxocyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid|2-[[(3E)-4-oxo-3-[[2-(phenylamino)naphthalen-1-yl]hydrazinylidene]-1-cyclohexa-1,5-dienyl]sulfonylamino]benzoic acid|2-[[[4-Hydroxy-3-[2-[2-(phenylamino)-1-naphthalenyl]diazenyl]phenyl]sulfonyl]amino]benzoic acid|Benzoic acid,2-[[[4-hydroxy-3-[2-[2-(phenylamino)-1-naphthalenyl]diazenyl]phenyl]sulfonyl]amino]-

CAS: 79817-64-4
Molecular Formula C29H22N4O5S
Molecular Weight 538.1311 g/mol
LogP 7.2034
Topological Polar Surface Area 140.45 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 538.1311
Monoisotopic Mass 538.1311
Heavy Atoms 39
Complexity 1823.115

Chemical Identifiers

CAS Number 79817-64-4
SMILES C1=CC=C(C=C1)NC2=C(C3=CC=CC=C3C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)NC5=CC=CC=C5C(=O)O)O

Product Overview

AC1NX4QA (CAS 79817-64-4), with molecular formula C29H22N4O5S and molecular weight 538.1311 g/mol. IUPAC: 2-[[3-[(2-anilinonaphthalen-1-yl)diazenyl]-4-hydroxyphenyl]sulfonylamino]benzoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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