50528-80-8
2,4,6-TRIFLUOROPHENYL ISOCYANATE
Name2,4,6-TRIFLUOROPHENYL ISOCYANATE
1Identification
【Name】
2,4,6-TRIFLUOROPHENYL ISOCYANATE
【CAS】
【MDL】
MFCD03426028
【English Synonyms】
【Formula】
C7 H2 F3 N O
【MolWeight】
173.093
【Inchi】
InChI=1S/C7H2F3NO/c8-4-1-5(9)7(11-3-12)6(10)2-4/h1-2H
【InChIKey】
InChIKey=XORSGSHLSDFOHP-UHFFFAOYSA-N
【SMILES】
c1c(cc(c(c1F)N=C=O)F)F
【MOL File】
2,4,6-TRIFLUOROPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
【WGK Germany】
3
4CML File
2,4,6-TRIFLUOROPHENYL ISOCYANATE.cml