566926-08-7
2-CYANO-N-[4-(TRIFLUOROMETHYL)BENZYL]ACETAMIDE
Name2-CYANO-N-[4-(TRIFLUOROMETHYL)BENZYL]ACETAMIDE
1Identification
【Name】
2-CYANO-N-[4-(TRIFLUOROMETHYL)BENZYL]ACETAMIDE
【CAS】
【MDL】
MFCD08689696
【English Synonyms】
【Formula】
C11 H9 F3 N2 O
【MolWeight】
242.199
【Inchi】
InChI=1S/C11H9F3N2O/c12-11(13,14)9-3-1-8(2-4-9)7-16-10(17)5-6-15/h1-4H,5,7H2,(H,16,17)
【InChIKey】
InChIKey=SPCRNPZHLOULGI-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CNC(=O)CC#N)C(F)(F)F
【MOL File】
2-CYANO-N-[4-(TRIFLU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-CYANO-N-[4-(TRIFLUOROMETHYL)BENZYL]ACETAMIDE.cml