Benzyl 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoate

Base Information

• Chemical Name: Benzyl 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoate
• CAS No.: 3003-38-1
• Molecular Formula: C24H20 N4 O3
• Molecular Weight: 412.4406
• European Community (EC) Number: 221-101-8
• DSSTox Substance ID: DTXSID701124406
• Nikkaji Number: J205.300D
• Mol file: 3003-38-1.mol

Synonyms:3003-38-1;EINECS 221-101-8;Benzyl 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoate;BENZYL 4-[(4,5-DIHYDRO-3-METHYL-5-OXO-1-PHENYL-1H-PYRAZOL-4-YL)AZO]BENZOATE;C24H20N4O3;DTXSID701124406;Phenylmethyl 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]benzoate;4-[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoic acid phenylmethyl ester;Benzoic acid, 4-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-, phenylmethyl ester

Chemical Property of Benzyl 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoate

Chemical Property:

• Vapor Pressure: 5.04E-15mmHg at 25°C
• Boiling Point: 614.3°Cat760mmHg
• Flash Point: 325.3°C
• PSA: 83.69000
• Density: 1.25g/cm³
• LogP: 4.41920
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 412.15354051
• Heavy Atom Count: 31
• Complexity: 687

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4