Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester

Base Information

• Chemical Name: Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester
• CAS No.: 73003-79-9
• Deprecated CAS: 105463-97-6
• Molecular Formula: C40H24 N6 O14 S3
• Molecular Weight: 908.84536
• European Community (EC) Number: 277-204-3
• DSSTox Substance ID: DTXSID7072709
• Nikkaji Number: J296.462G
• Wikidata: Q82000895
• Mol file: 73003-79-9.mol

Synonyms:73003-79-9;EINECS 277-204-3;Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester;Propyl 3,4,5-tris(((6-diazo-5,6-dihydro-5-oxo-1-naphthyl)sulphonyl)oxy)benzoate;Benzoic acid, 3,4,5-tris(((6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl)oxy)-, propyl ester;Propyl 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthyl)sulphonyl]oxy]benzoate;DTXSID7072709;C40H24N6O14S3;C40-H24-N6-O14-S3;3,4,5-Tris(6-diazo-5-oxo-5,6-dihydronaphthalene-1-ylsulfonyloxy)benzoic acid propyl ester;PROPYL 3,4,5-TRIS[[(6-DIAZO-5,6-DIHYDRO-5-OXO-1-NAPHTHYL)SULFONYL]OXY]BENZOATE

Chemical Property of Benzoic acid, 3,4,5-tris[[(6-diazo-5,6-dihydro-5-oxo-1-naphthalenyl)sulfonyl]oxy]-, propyl ester

Chemical Property:

• PSA: 344.93000
• LogP: 7.68298
• XLogP3: 12.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 13
• Exact Mass: 908.05126298
• Heavy Atom Count: 63
• Complexity: 2060

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N)OS(=O)(=O)C4=CC=CC5=C4C=CC(=C5[O-])[N+]#N)OS(=O)(=O)C6=CC=CC7=C6C=CC(=C7[O-])[N+]#N