886761-71-3
3-FLUORO-4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE
Name3-FLUORO-4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE
1Identification
【Name】
3-FLUORO-4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE
【CAS】
【MDL】
MFCD06660344
【English Synonyms】
【Formula】
C9 H5 F4 N O
【MolWeight】
219.137
【Inchi】
InChI=1S/C9H5F4NO/c10-7-5-6(3-4-14)1-2-8(7)15-9(11,12)13/h1-2,5H,3H2
【InChIKey】
InChIKey=MIDNSRCOEGRXAX-UHFFFAOYSA-N
【SMILES】
c1cc(c(cc1CC#N)F)OC(F)(F)F
【MOL File】
3-FLUORO-4-(TRIFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-FLUORO-4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE.cml