862574-87-6
1-(2,2-DIFLUOROBENZO[D][1,3]DIOXOL-5-YL)CYCLOPROPANECARBONITRILE
Name1-(2,2-DIFLUOROBENZO[D][1,3]DIOXOL-5-YL)CYCLOPROPANECARBONITRILE
1Identification
【Name】
1-(2,2-DIFLUOROBENZO[D][1,3]DIOXOL-5-YL)CYCLOPROPANECARBONITRILE
【CAS】
【MDL】
MFCD14155913
【English Synonyms】
【Formula】
C11 H7 F2 N O2
【MolWeight】
223.177
【Inchi】
InChI=1S/C11H7F2NO2/c12-11(13)15-8-2-1-7(5-9(8)16-11)10(6-14)3-4-10/h1-2,5H,3-4H2
【InChIKey】
InChIKey=RGKFSYDEMAFDQP-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1C3(CC3)C#N)OC(O2)(F)F
【MOL File】
1-(2,2-DIFLUOROBENZO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-(2,2-DIFLUOROBENZO[D][1,3]DIOXOL-5-YL)CYCLOPROPANECARBONITRILE.cml