2-((2-Cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl isobutyrate

Base Information

• Chemical Name: 2-((2-Cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl isobutyrate
• CAS No.: 75908-85-9
• Molecular Formula: C21H23 N5 O4
• Molecular Weight: 409.43842
• European Community (EC) Number: 278-342-7
• DSSTox Substance ID: DTXSID20888504
• Nikkaji Number: J319.154K
• Mol file: 75908-85-9.mol

Synonyms:75908-85-9;EINECS 278-342-7;2-((2-Cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl isobutyrate;2-[(2-CYANOETHYL)[4-[(4-NITROPHENYL)AZO]PHENYL]AMINO]ETHYL ISOBUTYRATE;Propanoic acid, 2-methyl-, 2-((2-cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl ester;Propanoic acid, 2-methyl-, 2-[(2-cyanoethyl)[4-[(4-nitrophenyl)azo]phenyl]amino]ethyl ester;Propanoic acid, 2-methyl-, 2-((2-cyanoethyl)(4-(2-(4-nitrophenyl)diazenyl)phenyl)amino)ethyl ester;Propanoic acid, 2-methyl-, 2-[(2-cyanoethyl)[4-[2-(4-nitrophenyl)diazenyl]phenyl]amino]ethyl ester;DTXSID20888504;2-Methylpropanoic acid 2-[(2-cyanoethyl)[4-[(4-nitrophenyl)azo]phenyl]amino]ethyl ester

Chemical Property of 2-((2-Cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl isobutyrate

Chemical Property:

• Vapor Pressure: 9.14E-15mmHg at 25°C
• Boiling Point: 608.8°C at 760 mmHg
• Flash Point: 322°C
• PSA: 123.87000
• Density: 1.21g/cm³
• LogP: 5.45268
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 10
• Exact Mass: 409.17500423
• Heavy Atom Count: 30
• Complexity: 623

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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