LN-094328
3-(2-CHLORO-4-METHYLBENZOYL)-4-PHENYLTHIOBICYCLO[3,2,1]OCT-2-EN-4-ONE , 0.95&0.99 , 156963-66-5
CAS NO.:156963-66-5
Empirical Formula: C22H19ClO4S2
Molecular Weight: 446.97
MDL number: MFCD29050502
Update time: 2023-04-23
PRODUCT Properties
Melting point: | 186~190℃ |
Boiling point: | 651.1±55.0 °C(Predicted) |
Density | 1.45±0.1 g/cm3(Predicted) |
storage temp. | 2-8°C |
solubility | Soluble in DMSO |
form | Solid |
color | Light yellow to brown |
InChI | InChI=1S/C22H19ClO4S2/c1-29(26,27)16-9-10-17(18(23)12-16)21(25)19-20(24)13-7-8-14(11-13)22(19)28-15-5-3-2-4-6-15/h2-6,9-10,12-14H,7-8,11H2,1H3 |
InChIKey | VIXCLRUCUMWJFF-UHFFFAOYSA-N |
SMILES | C12CC(CC1)C(SC1=CC=CC=C1)=C(C(=O)C1=CC=C(S(C)(=O)=O)C=C1Cl)C2=O |
EPA Substance Registry System | Benzobicyclon (156963-66-5) |
Description and Uses
Benzobicyclon is used in the development and application of multi-residue method to determine pesticides in agricultural water.