147149-97-1
4-NITRO-2-(TRIFLUOROMETHYL)PYRIDIN-1-IUM-1-OLATE
Name4-NITRO-2-(TRIFLUOROMETHYL)PYRIDIN-1-IUM-1-OLATE
1Identification
【Name】
4-NITRO-2-(TRIFLUOROMETHYL)PYRIDIN-1-IUM-1-OLATE
【CAS】
【MDL】
MFCD16876025
【English Synonyms】
【Formula】
C6 H3 F3 N2 O3
【MolWeight】
208.095
【Inchi】
InChI=1S/C6H3F3N2O3/c7-6(8,9)5-3-4(11(13)14)1-2-10(5)12/h1-3H
【InChIKey】
InChIKey=YAHZSCAQQRNLTM-UHFFFAOYSA-N
【SMILES】
c1c[n+](c(cc1[N+](=O)[O-])C(F)(F)F)[O-]
【MOL File】
4-NITRO-2-(TRIFLUORO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-NITRO-2-(TRIFLUOROMETHYL)PYRIDIN-1-IUM-1-OLATE.cml