681249-59-2
TERT-BUTYL 2-(TRIFLUOROMETHYL)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINE-7(8H)-CARBOXYLATE
NameTERT-BUTYL 2-(TRIFLUOROMETHYL)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINE-7(8H)-CARBOXYLATE
1Identification
【Name】
TERT-BUTYL 2-(TRIFLUOROMETHYL)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINE-7(8H)-CARBOXYLATE
【CAS】
【MDL】
MFCD11617305
【English Synonyms】
【Formula】
C11 H15 F3 N4 O2
【MolWeight】
292.259
【Inchi】
InChI=1S/C11H15F3N4O2/c1-10(2,3)20-9(19)17-4-5-18-7(6-17)15-8(16-18)11(12,13)14/h4-6H2,1-3H3
【InChIKey】
InChIKey=DMGHMNCRYGWVFF-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCn2c(nc(n2)C(F)(F)F)C1
【MOL File】
TERT-BUTYL 2-(TRIFLU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL 2-(TRIFLUOROMETHYL)-5,6-DIHYDRO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINE-7(8H)-CARBOXYLATE.cml