Benzonitrile, 2-((4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)azo)-5-nitro-

Base Information

• Chemical Name: Benzonitrile, 2-((4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)azo)-5-nitro-
• CAS No.: 66882-16-4
• Deprecated CAS: 62996-35-4,70007-56-6,12236-25-8,12223-78-8,12236-25-8,70007-56-6
• Molecular Formula: C22H23N5O6
• Molecular Weight: 453.4479
• European Community (EC) Number: 266-510-2
• DSSTox Substance ID: DTXSID1070480
• Nikkaji Number: J310.164I
• Mol file: 66882-16-4.mol

Synonyms:66882-16-4;Benzonitrile, 2-((4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)azo)-5-nitro-;2-[N-(2-acetyloxyethyl)-4-[(2-cyano-4-nitrophenyl)diazenyl]-3-methylanilino]ethyl acetate;EINECS 235-460-3;EINECS 266-510-2;Benzonitrile, 2-[[4-[bis[2-(acetyloxy)ethyl]amino]-2-methylphenyl]azo]-5-nitro-;2-((4-((Bis(2-hydroxyethyl))amino)-2-methylphenyl)azo)-5-nitrobenzonitrile diacetate;Benzonitrile, 2-(2-(4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)diazenyl)-5-nitro-;C.I.Disperse Violet 33;SCHEMBL9005020;DTXSID1070480;Benzonitrile, 2-[[4-[bis[2-(acetyloxy)ethyl] amino]-2-methylphenyl]azo]-5-nitro-;2-{[2-(acetyloxy)ethyl]-4-[(E)-(2-cyano-4-nitrophenyl)diazenyl]-3-methylanilino}ethyl acetate

Chemical Property of Benzonitrile, 2-((4-(bis(2-(acetyloxy)ethyl)amino)-2-methylphenyl)azo)-5-nitro-

Chemical Property:

• Vapor Pressure: 8.03E-16mmHg at 25°C
• Boiling Point: 630.8°Cat760mmHg
• PKA: 1.62±0.50(Predicted)
• Flash Point: 335.3°C
• PSA: 150.17000
• Density: 1.27g/cm³
• LogP: 4.64608
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 11
• Exact Mass: 453.16483347
• Heavy Atom Count: 33
• Complexity: 740

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N