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

Base Information

• Chemical Name: 3-(4-Methoxyphenyl)-9-methyl-6-propyl-6,9-dihydro-5H-1,2,4-triazolo(3,4-i)purin-5-one
• CAS No.: 135445-80-6
• Molecular Formula: C17H18N6O2
• Molecular Weight: 338.3638
• DSSTox Substance ID: DTXSID60929001
• Wikidata: Q82903831
• Mol file: 135445-80-6.mol

Synonyms:3-(4-Methoxyphenyl)-9-methyl-6-propyl-6,9-dihydro-5H-1,2,4-triazolo(3,4-i)purin-5-one;5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-3-(4-methoxyphenyl)-9-methyl-6-propyl-;6,9-Dihydro-9-methyl-6-n-propyl-3-(4-methoxyphenyl)-5H-1,2,4-triazolo(3,4-i)purin-5-one;135445-80-6;SCHEMBL9031456;DTXSID60929001;LS-156654;3-(4-Methoxyphenyl)-9-methyl-6-propyl-6,9-dihydro-5H-[1,2,4]triazolo[3,4-i]purin-5-one

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

Chemical Property:

• Vapor Pressure: 1.71E-17mmHg at 25°C
• Boiling Point: 663.9°Cat760mmHg
• Flash Point: 355.3°C
• Density: 1.41g/cm³
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 338.14912384
• Heavy Atom Count: 25
• Complexity: 498

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C2=C(C3=NN=C(N3C1=O)C4=CC=C(C=C4)OC)N(C=N2)C