29097-86-7
ALPHA,ALPHA'-DI-TERT-BUTYL-ALPHA,ALPHA'-DICYANO-2,3,5,6-TETRAFLUORO-1,4-BENZENEDIACETONITRILE
NameALPHA,ALPHA'-DI-TERT-BUTYL-ALPHA,ALPHA'-DICYANO-2,3,5,6-TETRAFLUORO-1,4-BENZENEDIACETONITRILE
1Identification
【Name】
ALPHA,ALPHA'-DI-TERT-BUTYL-ALPHA,ALPHA'-DICYANO-2,3,5,6-TETRAFLUORO-1,4-BENZENEDIACETONITRILE
【CAS】
【MDL】
MFCD00075577
【English Synonyms】
【Formula】
C20 H18 F4 N4
【MolWeight】
390.382
【Inchi】
InChI=1S/C20H18F4N4/c1-17(2,3)19(7-25,8-26)11-13(21)15(23)12(16(24)14(11)22)20(9-27,10-28)18(4,5)6/h1-6H3
【InChIKey】
InChIKey=XHRGWBCRHKHPDP-UHFFFAOYSA-N
【SMILES】
CC(C)(C)C(C#N)(C#N)c1c(c(c(c(c1F)F)C(C#N)(C#N)C(C)(C)C)F)F
【MOL File】
ALPHA,ALPHA'-DI-TERT….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:8.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ALPHA,ALPHA'-DI-TERT-BUTYL-ALPHA,ALPHA'-DICYANO-2,3,5,6-TETRAFLUORO-1,4-BENZENEDIACETONITRILE.cml