1H-Pyrazole-3-carboxylic acid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-

Base Information

• Chemical Name: 1H-Pyrazole-3-carboxylic acid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-
• CAS No.: 89-26-9
• Molecular Formula: C10H9N3O3
• Molecular Weight: 219.19676
• Hs Code.: 2933199090
• European Community (EC) Number: 201-892-6
• NSC Number: 4987
• UNII: 7D7DY8T7W6
• DSSTox Substance ID: DTXSID0058982
• Nikkaji Number: J182.060E
• Wikidata: Q81988626
• Mol file: 89-26-9.mol

Synonyms:89-26-9;1-(3-aminophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxylic acid;1H-Pyrazole-3-carboxylic acid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-;1-(3-aminophenyl)-5-oxo-4H-pyrazole-3-carboxylic acid;1-(3-Aminophenyl)-4,5-dihydro-5-oxo-1H-pyrazole-3-carboxylic acid;1-(m-Aminophenyl)-5-oxo-2-pyrazoline-3-carboxylic acid;7D7DY8T7W6;NSC 4987;NSC-4987;EINECS 201-892-6;1-(meta-Aminophenyl)-5-oxo-2-pyrazoline-3-carboxylic acid;2-Pyrazoline-3-carboxylic acid, 1-(m-aminophenyl)-5-oxo-;NSC4987;UNII-7D7DY8T7W6;Oprea1_782723;DTXSID0058982;BBL004769;MFCD00043812;STK367437;AKOS005444421;BS-3115;BB 0242377;CS-0312723;C77002;1H-Pyrazole-3-carboxylic acid,5-dihydro-5-oxo-;A922538;1-(3-aminophenyl)-4,5-dihydro-5-oxo-1H-pyrazol-3-carboxylsyre;1-(3-aminophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxylicacid;1-(3-Amino-phenyl)-5-oxo-4,5-dihydro-1H-py razole-3-carboxylic acid;1-(3-amino-phenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxylic acid, AldrichCPR

Chemical Property of 1H-Pyrazole-3-carboxylic acid, 1-(3-aminophenyl)-4,5-dihydro-5-oxo-

Chemical Property:

• Vapor Pressure: 6.46E-10mmHg at 25°C
• Refractive Index: 1.71
• Boiling Point: 477.3 °C at 760 mmHg
• Flash Point: 242.4 °C
• PSA: 95.99000
• Density: 1.55 g/cm³
• LogP: 0.52790
• Storage Temp.: Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 219.06439116
• Heavy Atom Count: 16
• Complexity: 353

Purity/Quality:

96% 1H NMR ^*data from raw suppliers

1-(3-Aminophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=NN(C1=O)C2=CC=CC(=C2)N)C(=O)O