5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-3-(4-nitrophenyl)-6-propyl-

Base Information

• Chemical Name: 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-3-(4-nitrophenyl)-6-propyl-
• CAS No.: 135445-87-3
• Molecular Formula: C16H15N7O3
• Molecular Weight: 353.3354
• DSSTox Substance ID: DTXSID00159365
• Wikidata: Q83027678
• Mol file: 135445-87-3.mol

Synonyms:5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-3-(4-nitrophenyl)-6-propyl-;9-Methyl-3-(4-nitrophenyl)-6-propyl-6,9-dihydro-5H-1,2,4-triazolo(3,4-i)purin-5-one;6,9-Dihydro-9-methyl-6-n-propyl-3-(4-nitrophenyl)-5H-1,2,4-triazolo(3,4-i)purin-5-one;135445-87-3;SCHEMBL9030675;DTXSID00159365;C16H15N7O3;C16-H15-N7-O3;LS-156657

Chemical Property of 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-3-(4-nitrophenyl)-6-propyl-

Chemical Property:

• Vapor Pressure: 2.24E-20mmHg at 25°C
• Boiling Point: 716.4°Cat760mmHg
• Flash Point: 387.1°C
• Density: 1.58g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 353.12363737
• Heavy Atom Count: 26
• Complexity: 563

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C2=C(C3=NN=C(N3C1=O)C4=CC=C(C=C4)[N+](=O)[O-])N(C=N2)C

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