898748-53-3
6-CHLORO-4,7-DIMETHOXY-2(3H)-BENZOTHIAZOLONE
Name
6-CHLORO-4,7-DIMETHOXY-2(3H)-BENZOTHIAZOLONE
Formula
C9 H8 Cl N O3 S
MolWeight
245.685
1Identification
【Name】
6-CHLORO-4,7-DIMETHOXY-2(3H)-BENZOTHIAZOLONE
【CAS】
【MDL】
MFCD09748562
【English Synonyms】
【Formula】
C9 H8 Cl N O3 S
【MolWeight】
245.685
【Inchi】
InChI=1S/C9H8ClNO3S/c1-13-5-3-4(10)7(14-2)8-6(5)11-9(12)15-8/h3H,1-2H3,(H,11,12)
【InChIKey】
InChIKey=AOALCAWMNKBKDU-UHFFFAOYSA-N
【SMILES】
COc1cc(c(c2c1[nH]c(=O)s2)OC)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-CHLORO-4,7-DIMETHOXY-2(3H)-BENZOTHIAZOLONE.cml
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