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CAS Number: 21243-12-9
8-fluorothiochroman-4-one

Structure

 8-fluorothiochroman-4-one
Name: 8-fluorothiochroman-4-one
Synonyms:
General Information
Product Number: 21243129

CAS Registry Number 21243-12-9
Name:
4H-?1-?Benzothiopyran-?4-?one, 8-?fluoro-?2,?3-?dihydro-
Thiochroman-4-one, 8-fluoro- (8CI)
8-Fluoro-2,3-dihydro-4H-thiochromen-4-one
8-Fluorothiochroman-4-one

 

Chemical Formula: C9H7FOS
Exact Mass: 182.02
Molecular Weight: 182.21
m/z: 182.02 (100.0%), 183.02 (10.6%), 184.02 (4.8%)

 

InChI:InChI=1S/C9H7FOS/c10-7-3-1-2-6-8(11)4-5-12-9(6)7/h1-3H,4-5H2

InChI Key:DLPXAUNBZAYCFB-UHFFFAOYSA-N

Canonical SMILES:C1CSC2=C(C1=O)C=CC=C2F

 

Thermal Properties Value Condition Note
Melting Point 80-81 °C   (1)CAS

Specification

98%
References

(1) Fravolini, Arnaldo; Annali di Chimica (Rome, Italy) 1968, V58(10), P1155-62 CAPLUS
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