5-(1-Methylcyclopropyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Base Information

• Chemical Name: 5-(1-Methylcyclopropyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
• CAS No.: 436088-54-9
• Molecular Formula: C12H14 F3 N3 O2
• Molecular Weight: 289.25
• DSSTox Substance ID: DTXSID10420917
• ChEMBL ID: CHEMBL1596561
• Mol file: 436088-54-9.mol

Synonyms:436088-54-9;5-(1-Methylcyclopropyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid;5-(1-Methyl-cyclopropyl)-7-trifluoromethyl-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrimidine-2-carboxylic;BAS 03183423;5-(1-methyl-cyclopropyl)-7-trifluoromethyl-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid;HMS2640F07;MLS000716471;CHEMBL1596561;DTXSID10420917;AKOS000300075;AKOS016346814;SMR000277988

Chemical Property of 5-(1-Methylcyclopropyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.24E-05mmHg at 25°C
• Boiling Point: 343.7°Cat760mmHg
• Flash Point: 161.7°C
• PSA: 67.15000
• Density: g/cm³
• LogP: 2.80700
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 289.10381118
• Heavy Atom Count: 20
• Complexity: 425

Purity/Quality:

98%min ^*data from raw suppliers

5-(1-Methyl-cyclopropyl)-7-trifluoromethyl-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrimidine-2-carboxylic ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC1)C2CC(N3C(=CC(=N3)C(=O)O)N2)C(F)(F)F