methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate

Base Information

• Chemical Name: methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate
• CAS No.: 1260-35-1
• Molecular Formula: C22H24 Cl N5 O7
• Molecular Weight: 505.90826
• European Community (EC) Number: 215-024-9
• DSSTox Substance ID: DTXSID301037512
• Nikkaji Number: J217.084A
• Mol file: 1260-35-1.mol

Synonyms:1260-35-1;EINECS 215-024-9;methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate;Methyl N-(3-(acetylamino)-4-((2-chloro-4-nitrophenyl)azo)phenyl)-N-(3-methoxy-3-oxopropyl)-beta-alaninate;methyl N-[3-(acetylamino)-4-[(2-chloro-4-nitrophenyl)azo]phenyl]-N-(3-methoxy-3-oxopropyl)-beta-alan;METHYL N-[3-(ACETYLAMINO)-4-[(2-CHLORO-4-NITROPHENYL)AZO]PHENYL]-N-(3-METHOXY-3-OXOPROPYL)-BETA-ALANINATE;SCHEMBL11133352;DTXSID301037512;Dimethyl 3,3'-({3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]phenyl}imino)dipropanoate;beta-Alanine, N-(3-(acetylamino)-4-((2-chloro-4-nitrophenyl)azo)phenyl)-N-(3-methoxy-3-oxopropyl)-, methyl ester;N-[3-(Acetylamino)-4-[(2-chloro-4-nitrophenyl)azo]phenyl]-N-(3-methoxy-3-oxopropyl)-beta-alanine methyl ester

Chemical Property of methyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-methoxy-3-oxopropyl)anilino]propanoate

Chemical Property:

• Boiling Point: 707.2oC at 760 mmHg
• Flash Point: 381.5oC
• PSA: 158.97000
• Density: 1.36g/cm3
• LogP: 5.72730
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 12
• Exact Mass: 505.1364258
• Heavy Atom Count: 35
• Complexity: 758

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=C(C=CC(=C1)N(CCC(=O)OC)CCC(=O)OC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl