886361-22-4
2,3,4,5,6-PENTAFLUOROPHENYL 4-BROMO-2-CHLOROBENZENESULFONATE
Name2,3,4,5,6-PENTAFLUOROPHENYL 4-BROMO-2-CHLOROBENZENESULFONATE
FormulaC12 H3 Br Cl F5 O3 S
1Identification
【Name】
2,3,4,5,6-PENTAFLUOROPHENYL 4-BROMO-2-CHLOROBENZENESULFONATE
【CAS】
【MDL】
MFCD05975147
【English Synonyms】
【Formula】
C12 H3 Br Cl F5 O3 S
【MolWeight】
437.566
【Inchi】
InChI=1S/C12H3BrClF5O3S/c13-4-1-2-6(5(14)3-4)23(20,21)22-12-10(18)8(16)7(15)9(17)11(12)19/h1-3H
【InChIKey】
InChIKey=IJNHXVWTRCYNQH-UHFFFAOYSA-N
【SMILES】
c1cc(c(cc1Br)Cl)S(=O)(=O)Oc2c(c(c(c(c2F)F)F)F)F
【MOL File】
2,3,4,5,6-PENTAFLUOR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2,3,4,5,6-PENTAFLUOROPHENYL 4-BROMO-2-CHLOROBENZENESULFONATE.cml