252949-73-8
6-CHLORO-4-[[(DIETHOXYPHOSPHORYL)OXY]IMINO]-2-METHYL-3,4-DIHYDRO-1-BENZOTHIOPYRAN-1,1(2H)-DIONE
Name6-CHLORO-4-[[(DIETHOXYPHOSPHORYL)OXY]IMINO]-2-METHYL-3,4-DIHYDRO-1-BENZOTHIOPYRAN-1,1(2H)-DIONE
FormulaC14 H19 Cl N O6 P S
1Identification
【Name】
6-CHLORO-4-[[(DIETHOXYPHOSPHORYL)OXY]IMINO]-2-METHYL-3,4-DIHYDRO-1-BENZOTHIOPYRAN-1,1(2H)-DIONE
【CAS】
【MDL】
MFCD01567029
【English Synonyms】
【Formula】
C14 H19 Cl N O6 P S
【MolWeight】
395.798
【Inchi】
InChI=1S/C14H19ClNO6PS/c1-4-20-23(17,21-5-2)22-16-13-8-10(3)24(18,19)14-7-6-11(15)9-12(13)14/h6-7,9-10H,4-5,8H2,1-3H3/b16-13+
【InChIKey】
InChIKey=QMLIXMCZFLCWKR-DTQAZKPQSA-N
【SMILES】
CCOP(=O)(OCC)O/N=C/1\CC(S(=O)(=O)c2c1cc(cc2)Cl)C
【MOL File】
6-CHLORO-4-[[(DIETHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-CHLORO-4-[[(DIETHOXYPHOSPHORYL)OXY]IMINO]-2-METHYL-3,4-DIHYDRO-1-BENZOTHIOPYRAN-1,1(2H)-DIONE.cml