RefChem:299343 structure

RefChem:299343

5-[[5-[(4-anilino-3-sulfophenyl)diazenyl]-2,4-dihydroxyphenyl]diazenyl]-4-hydroxy-3-[(4-nitrophenyl)diazenyl]naphthalene-2,7-disulfonic acid

Also Known As: 2,7-Naphthalenedisulfonic acid, 5-((2,4-dihydroxy-5-((4-(phenylamino)-3-sulfophenyl)azo)phenyl)azo)-4-hydroxy-3-((4-nitrophenyl)azo)-|5-[2-[2,4-Dihydroxy-5-[2-[4-(phenylamino)-3-sulfophenyl]diazenyl]phenyl]diazenyl]-4-hydroxy-3-[2-(4-nitrophenyl)diazenyl]-2,7-naphthalenedisulfonic acid|(3Z)-5-[[(3Z)-3-[(4-anilino-3-sulfophenyl)hydrazinylidene]-6-hydroxy-4-oxocyclohexa-1,5-dien-1-yl]diazenyl]-3-[(4-nitrophenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid|1-Naphthol-3,6-disulfonic acid, 8-[5-(4-anilino-3-sulfophenylazo)-2,4-dihydroxyphenylazo]-2-(p-nitrophenylazo)-|2,7-Naphthalenedisulfonic acid, 5-(2-(2,4-dihydroxy-5-(2-(4-(phenylamino)-3-sulfophenyl)diazenyl)phenyl)diazenyl)-4-hydroxy-3-(2-(4-nitrophenyl)diazenyl)-|2,7-Naphthalenedisulfonic acid, 5-[[2,4-dihydroxy-5-[[4-(phenylamino)-3-sulfophenyl]azo]phenyl]azo]-4-hydroxy-3-[(4-nitrophenyl)azo]-|2,7-Naphthalenedisulfonic acid, 5-[2-[2,4-dihydroxy-5-[2-[4-(phenylamino)-3-sulfophenyl]diazenyl]phenyl]diazenyl]-4-hydroxy-3-[2-(4-nitrophenyl)diazenyl]-|5-({5-[(4-Anilino-3-sulfophenyl)diazenyl]-2,4-dihydroxyphenyl}diazenyl)-4-hydroxy-3-[(4-nitrophenyl)diazenyl]naphthalene-2,7-disulfonic acid|5-(2-(2,4-Dihydroxy-5-(2-(4-(phenylamino)-3-sulfophenyl)diazenyl)phenyl)diazenyl)-4-hydroxy-3-(2-(4-nitrophenyl)diazenyl)-2,7-naphthalenedisulfonic acid|5-[[2,4-Dihydroxy-5-[[4-(phenylamino)-3-sulfophenyl]azo]phenyl]azo]-4-hydroxy-3-[(4-nitrophenyl)azo]-2,7-naphthalenedisulfonic acid|5-[2-(2,4-dihydroxy-5-{2-[4-(phenylamino)-3-sulfophenyl]diazen-1-yl}phenyl)diazen-1-yl]-4-hydroxy-3-[2-(4-nitrophenyl)diazen-1-yl]naphthalene-2,7-disulfonic acid

CAS: 72138-99-9
Molecular Formula C34H24N8O14S3
Molecular Weight 864.05743 g/mol
LogP 5.6
Topological Polar Surface Area 381.0 Ų
Hydrogen Bond Donors 7
Hydrogen Bond Acceptors 21
Rotatable Bonds 11
Exact Mass 864.05743
Monoisotopic Mass 864.05743
Heavy Atoms 59
Complexity 1870.0

Chemical Identifiers

CAS Number 72138-99-9
SMILES C1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=CC(=C(C=C3O)O)N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=C(C(=C5O)N=NC6=CC=C(C=C6)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O
InChIKey VRMPSAPCCDYZQS-UHFFFAOYSA-N

Product Overview

RefChem:299343 (CAS 72138-99-9), with molecular formula C34H24N8O14S3 and molecular weight 864.05743 g/mol. IUPAC: 5-[[5-[(4-anilino-3-sulfophenyl)diazenyl]-2,4-dihydroxyphenyl]diazenyl]-4-hydroxy-3-[(4-nitrophenyl)diazenyl]naphthalene-2,7-disulfonic acid.

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