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CAS Number: 33449-56-8
3-methyl-6,7-dihydrobenzo[b]thiophen-4(5H)-one

Structure

 3-methyl-6,7-dihydrobenzo[b]thiophen-4(5H)-one
Name: 3-methyl-6,7-dihydrobenzo[b]thiophen-4(5H)-one
Synonyms:
General Information
Product Number: 33449568

CAS Registry Number 33449-56-8
Name:
Benzo[b]?thiophen-?4(5H)?-?one, 6,?7-?dihydro-?3-?methyl-
3-Methyl-4-oxo-4,5,6,7-tetrahydrobenzo[b]thiophene
4,5,6,7-Tetrahydro-3-methyl-4-oxobenzo[b]thiophene

 

Chemical Formula: C9H10OS
Exact Mass: 166.05
Molecular Weight: 166.24
m/z: 166.05 (100.0%), 167.05 (9.9%), 168.04 (4.5%)

 

InChI:InChI=1S/C9H10OS/c1-6-5-11-8-4-2-3-7(10)9(6)8/h5H,2-4H2,1H3

InChI Key:BECAJEAHWWQBBH-UHFFFAOYSA-N

Canonical SMILES:CC1=CSC2=C1C(=O)CCC2

 

Thermal Properties Value Condition Note
Melting Point 27-28 °C Solv: ligroine (8032-32-4) (1)IC

Specification

98%
References
  1. (1) Asprou, Chris M.; Journal of Heterocyclic Chemistry 1980, V17(1), P87-92 CAPLUS
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