861408-98-2
5-CYCLOPROPYL-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
Name5-CYCLOPROPYL-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
5-CYCLOPROPYL-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD04967177
【English Synonyms】
【Formula】
C11 H8 F3 N3 O2
【MolWeight】
271.197
【Inchi】
InChI=1S/C11H8F3N3O2/c12-11(13,14)8-3-7(5-1-2-5)16-9-6(10(18)19)4-15-17(8)9/h3-5H,1-2H2,(H,18,19)
【InChIKey】
InChIKey=AHOQVWZLSOACNB-UHFFFAOYSA-N
【SMILES】
c1c(nc2c(cnn2c1C(F)(F)F)C(=O)O)C3CC3
【MOL File】
5-CYCLOPROPYL-7-(TRI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-CYCLOPROPYL-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID.cml