2245335-71-9

Name 1,3,2-Benzoxathiaphosphole, hexahydro-3a-methyl-6-(1-methylethenyl)-2-[(2,3,4,5,6-pentafluorophenyl)thio]-, 2-sulfide, (2R,3aR,6S,7aR)-
CAS 2245335-71-9
Molecular Formula C16H16F5OPS3
Molecular Weight 446.46
MOL File 2245335-71-9.mol

Chemical Properties

Melting point  102-107 °C
Boiling point  423.5±55.0 °C(Predicted)
density  1.46±0.1 g/cm3(Predicted)
storage temp.  2-8°C, stored under nitrogen
form  powder or crystals
Appearance White to off-white Solid
InChI InChI=1S/C16H16F5OPS3/c1-7(2)8-4-5-16(3)9(6-8)22-23(24,26-16)25-15-13(20)11(18)10(17)12(19)14(15)21/h8-9H,1,4-6H2,2-3H3/t8-,9+,16+,23-/m0/s1
InChIKey YPYCUYPOHPPYAS-WHJDOBIZSA-N
SMILES O1[C@]2([H])C[C@@H](C(C)=C)CC[C@@]2(C)S[P@@]1(=S)SC1=C(F)C(F)=C(F)C(F)=C1F

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier