Antipyrine, 4-(9H-purin-6-ylamino)-

Base Information

• Chemical Name: Antipyrine, 4-(9H-purin-6-ylamino)-
• CAS No.: 52972-57-3
• Molecular Formula: C16H15N7O
• Molecular Weight: 321.3366
• DSSTox Substance ID: DTXSID80201013
• Wikidata: Q83074202
• ChEMBL ID: CHEMBL1518915
• Mol file: 52972-57-3.mol

Synonyms:ANTIPYRINE, 4-(9H-PURIN-6-YLAMINO)-;4-(9H-Purin-6-ylamino)antipyrine;52972-57-3;1-Phenyl-2,3-dimethyl-4-(6'-purinylamino)pyrazolone-5;SMR000017628;Oprea1_372263;MLS000101219;CHEMBL1518915;C16H15N7O;DTXSID80201013;HMS2254H11;C16-H15-N7-O;STK944622;AKOS001770221;LS-21409;SR-01000007305;SR-01000007305-1;1,5-dimethyl-2-phenyl-4-(9H-purin-6-ylamino)-1,2-dihydro-3H-pyrazol-3-one

Chemical Property of Antipyrine, 4-(9H-purin-6-ylamino)-

Chemical Property:

• Vapor Pressure: 9.18E-14mmHg at 25°C
• Boiling Point: 587.1°Cat760mmHg
• Flash Point: 308.8°C
• Density: 1.475g/cm³
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 321.13380813
• Heavy Atom Count: 24
• Complexity: 531

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NC=NC4=C3NC=N4

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