Propanenitrile, 3-[ethyl[4-[(6-nitro-2-benzothiazolyl)azo]phenyl]amino]-

Base Information

• Chemical Name: Propanenitrile, 3-[ethyl[4-[(6-nitro-2-benzothiazolyl)azo]phenyl]amino]-
• CAS No.: 25510-81-0
• Deprecated CAS: 72827-96-4,88650-97-9,88650-97-9
• Molecular Formula: C18H16 N6 O2 S
• Molecular Weight: 380.4236
• European Community (EC) Number: 247-055-9
• DSSTox Substance ID: DTXSID3067104
• Nikkaji Number: J250.486C
• Mol file: 25510-81-0.mol

Synonyms:25510-81-0;Propanenitrile, 3-[ethyl[4-[(6-nitro-2-benzothiazolyl)azo]phenyl]amino]-;3-[ethyl[4-[(6-nitrobenzothiazol-2-yl)azo]phenyl]amino]propiononitrile;3-[N-ethyl-4-[(6-nitro-1,3-benzothiazol-2-yl)diazenyl]anilino]propanenitrile;3-(Ethyl(4-((6-nitrobenzothiazol-2-yl)azo)phenyl)amino)propiononitrile;EINECS 247-055-9;C18H16N6O2S;Benzothiazole, 2-((p-(N-(2-cyanoethyl)-N-ethylamino)phenylazo)-6-nitro-;Propanenitrile, 3-(ethyl(4-((6-nitro-2-benzothiazolyl)azo)phenyl)amino)-;DISPERSE RED 145;Propanenitrile, 3-(ethyl(4-(2-(6-nitro-2-benzothiazolyl)diazenyl)phenyl)amino)-;C.I. Disperse Red 319;DTXSID3067104;SCHEMBL17522752;SCHEMBL21357710;C18-H16-N6-O2-S;Propanenitrile, 3-[ethyl[4-[(6-nitro-2-benzothiazolyl) azo]phenyl]amino]-;3-[Ethyl[4-(6-nitro-2-benzothiazolylazo)phenyl]amino]propanenitrile

Chemical Property of Propanenitrile, 3-[ethyl[4-[(6-nitro-2-benzothiazolyl)azo]phenyl]amino]-

Chemical Property:

• Vapor Pressure: 4.09E-15mmHg at 25°C
• Boiling Point: 616.2°Cat760mmHg
• PKA: 2.12±0.50(Predicted)
• Flash Point: 326.4°C
• PSA: 138.70000
• Density: 1.37g/cm³
• LogP: 5.88308
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 380.10554495
• Heavy Atom Count: 27
• Complexity: 580

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CCC#N)C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]