835632-38-7
SPIRO[[1]BENZOTHIENO[2,3-D]PYRIMIDINE-7(6H),2'-[1,3]DIOXOLANE], 4-CHLORO-5,8-DIHYDRO
NameSPIRO[[1]BENZOTHIENO[2,3-D]PYRIMIDINE-7(6H),2'-[1,3]DIOXOLANE], 4-CHLORO-5,8-DIHYDRO
FormulaC12 H11 Cl N2 O2 S
1Identification
【Name】
SPIRO[[1]BENZOTHIENO[2,3-D]PYRIMIDINE-7(6H),2'-[1,3]DIOXOLANE], 4-CHLORO-5,8-DIHYDRO
【CAS】
【MDL】
MFCD09863899
【English Synonyms】
【Formula】
C12 H11 Cl N2 O2 S
【MolWeight】
282.75
【Inchi】
InChI=1S/C12H11ClN2O2S/c13-10-9-7-1-2-12(16-3-4-17-12)5-8(7)18-11(9)15-6-14-10/h6H,1-5H2
【InChIKey】
InChIKey=VPKFDNXKBGWAOD-UHFFFAOYSA-N
【SMILES】
c1nc2c(c3c(s2)CC4(CC3)OCCO4)c(n1)Cl
【MOL File】
SPIRO[[1]BENZOTHIENO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
SPIRO[[1]BENZOTHIENO[2,3-D]PYRIMIDINE-7(6H),2'-[1,3]DIOXOLANE], 4-CHLORO-5,8-DIHYDRO.cml