5858-22-0
6-METHOXYBENZO[B]THIOPHEN-3(2H)-ONE
Name
6-METHOXYBENZO[B]THIOPHEN-3(2H)-ONE
Formula
C9 H8 O2 S
MolWeight
180.226
1Identification
【Name】
6-METHOXYBENZO[B]THIOPHEN-3(2H)-ONE
【CAS】
【MDL】
MFCD18974641
【English Synonyms】
【Formula】
C9 H8 O2 S
【MolWeight】
180.226
【Inchi】
InChI=1S/C9H8O2S/c1-11-6-2-3-7-8(10)5-12-9(7)4-6/h2-4H,5H2,1H3
【InChIKey】
InChIKey=UXEJVCIWCVCHOZ-UHFFFAOYSA-N
【SMILES】
COc1ccc2c(c1)SCC2=O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-METHOXYBENZO[B]THIOPHEN-3(2H)-ONE.cml
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