53173-72-1
3,5-BIS(1,1,1,3,3,3-HEXAFLUORO-2-HYDROXYPROPYL)IODOBENZENE
Name3,5-BIS(1,1,1,3,3,3-HEXAFLUORO-2-HYDROXYPROPYL)IODOBENZENE
1Identification
【Name】
3,5-BIS(1,1,1,3,3,3-HEXAFLUORO-2-HYDROXYPROPYL)IODOBENZENE
【CAS】
【MDL】
MFCD04038221
【English Synonyms】
【Formula】
C12 H5 F12 I O2
【MolWeight】
536.045
【Inchi】
InChI=1S/C12H5F12IO2/c13-9(14,15)7(26,10(16,17)18)4-1-5(3-6(25)2-4)8(27,11(19,20)21)12(22,23)24/h1-3,26-27H
【InChIKey】
InChIKey=KVOQFAYORNCNFD-UHFFFAOYSA-N
【SMILES】
c1c(cc(cc1C(C(F)(F)F)(C(F)(F)F)O)I)C(C(F)(F)F)(C(F)(F)F)O
【MOL File】
3,5-BIS(1,1,1,3,3,3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-BIS(1,1,1,3,3,3-HEXAFLUORO-2-HYDROXYPROPYL)IODOBENZENE.cml