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

Base Information

• Chemical Name: 5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-(trifluoromethyl)phenyl)-
• CAS No.: 135445-86-2
• Molecular Formula: C17H15 F3 N6 O
• Molecular Weight: 376.3358
• DSSTox Substance ID: DTXSID40159364
• Wikidata: Q83027677
• Mol file: 135445-86-2.mol

Synonyms:5H-1,2,4-Triazolo(3,4-i)purin-5-one, 6,9-dihydro-9-methyl-6-propyl-3-(4-(trifluoromethyl)phenyl)-;135445-86-2;SCHEMBL9031860;C17H15F3N6O;DTXSID40159364;IRDALKBZZCVJJG-UHFFFAOYSA-N;C17-H15-F3-N6-O;LS-156665

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

Chemical Property:

• Vapor Pressure: 1.6E-15mmHg at 25°C
• Boiling Point: 624.6°Cat760mmHg
• Flash Point: 331.6°C
• Density: 1.51g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 376.12594361
• Heavy Atom Count: 27
• Complexity: 567

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

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)C(F)(F)F)N(C=N2)C

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