5-Acetamido-4-hydroxy-3-(phenyldiazenyl)naphthalene-2,7-disulfonic acid

Base Information

• Chemical Name: 5-Acetamido-4-hydroxy-3-(phenyldiazenyl)naphthalene-2,7-disulfonic acid
• CAS No.: 25317-20-8
• Molecular Formula: C18H15 N3 O8 S2
• Molecular Weight: 465.457
• European Community (EC) Number: 246-823-0
• UNII: E0X7EHI364
• DSSTox Substance ID: DTXSID5045047
• Nikkaji Number: J250.420K
• Wikidata: Q27159645,Q27276715
• ChEMBL ID: CHEMBL3306478
• Mol file: 25317-20-8.mol

Synonyms:acid red 1 free acid;25317-20-8;C.I. Acid Red 1 parent;UNII-E0X7EHI364;5-acetamido-4-hydroxy-3-(phenyldiazenyl)naphthalene-2,7-disulfonic acid;E0X7EHI364;CHEBI:87465;EINECS 246-823-0;2,7-Naphthalenedisulfonic acid, 5-(acetylamino)-4-hydroxy-3-(phenylazo)-;5-(Acetylamino)-4-hydroxy-3-(phenylazo)naphthalene-2,7-disulphonic acid;5-(Acetylamino)-4-hydroxy-3-(phenylazo)naphthalene-2,7-disulphonicacid;Azorhodine 2G;azophloxine free acid;Vopsider red ASTR G;CI ACID RED 1 PARENT;acid red 1 (free acid form);CHEMBL3306478;DTXSID5045047;SCHEMBL10050360;SCHEMBL12954923;SCHEMBL15115323;SCHEMBL21274210;C18H15N3O8S2;C18-H15-N3-O8-S2;E128;Q27159645;Q27276715;benzeneazo-8-acetylamino-1-naphthol-3,6-disulfonic acid;5-acetamido-4-hydroxy-3-phenylazo-naphthalene-2,7-disulfonic acid;2,7-NAPHTHALENEDISULFONIC ACID, 5-(ACETYLAMINO)-4-HYDROXY-3-(2-PHENYLDIAZENYL)-;4-(Acetylamino)-3-hydroxy-2-(phenyldiazenyl)naphthalen-1,1,6,8a-tetrasulfonic acid;5-(Acetylamino)-4-hydroxy-3-(phenylazo)-2,7-naphthalenedisulfonic acid, 9CI;5-acetamido-4-hydroxy-3-[(E)-phenyldiazenyl]naphthalene-2,7-disulfonic acid;5-acetamido-4-hydroxy-3-[(EZ)-phenyldiazenyl]naphthalene-2,7-disulfonic acid

Chemical Property of 5-Acetamido-4-hydroxy-3-(phenyldiazenyl)naphthalene-2,7-disulfonic acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• PKA: -0.95±0.40(Predicted)
• Flash Point: °C
• PSA: 199.55000
• Density: 1.66g/cm³
• LogP: 5.64720
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 5
• Exact Mass: 465.03005679
• Heavy Atom Count: 31
• Complexity: 890

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C(=C2O)N=NC3=CC=CC=C3)S(=O)(=O)O