Acetamide, N-(2-(5-amino-7-bromo-4-chloro-2H-benzotriazol-2-yl)-5-(bis(2-methoxyethyl)amino)-4-methoxyphenyl)-

Base Information

• Chemical Name: Acetamide, N-(2-(5-amino-7-bromo-4-chloro-2H-benzotriazol-2-yl)-5-(bis(2-methoxyethyl)amino)-4-methoxyphenyl)-
• CAS No.: 194590-84-6
• Molecular Formula: C21H26BrClN6O4
• Molecular Weight: 541.83
• DSSTox Substance ID: DTXSID50173096
• Nikkaji Number: J890.550I
• Wikidata: Q83043196
• Mol file: 194590-84-6.mol

Synonyms:2-(2-(acetylamino)-4-(bis(2-methoxyethyl)amino)-5-methoxyphenyl)-5-amino-7-bromo-4-chloro-2H-benzotriazole;PBTA-1;PBTA-3

Chemical Property of Acetamide, N-(2-(5-amino-7-bromo-4-chloro-2H-benzotriazol-2-yl)-5-(bis(2-methoxyethyl)amino)-4-methoxyphenyl)-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 120.25000
• Density: 1.53g/cm³
• LogP: 4.71550
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 10
• Exact Mass: 540.08874
• Heavy Atom Count: 33
• Complexity: 632

Purity/Quality:

99% ^*data from raw suppliers

2-(2-(ACETYLAMINO)-4-(BIS(2-METHOXYETHYL)AMINO)-5-METHOXYPHENYL)-5-AMINO-7-BROMO-4-CHLORO-2H-BENZOTRIAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC(=C(C=C1N2N=C3C(=CC(=C(C3=N2)Cl)N)Br)OC)N(CCOC)CCOC