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CAS Number: 108127-47-5
6-hydroxythiochroman-4-one

Structure

 6-hydroxythiochroman-4-one
Name: 6-hydroxythiochroman-4-one
Synonyms:
General Information
Product Number: 108127475

CAS Registry Number 108127-47-5
Name:
4H-?1-?Benzothiopyran-?4-?one, 2,?3-?dihydro-?6-?hydroxy-
Thiochroman-4-one, 6-hydroxy- (6CI)
6-Hydroxythiochroman-4-one

 

Chemical Formula: C9H8O2S
Exact Mass: 180.02
Molecular Weight: 180.22
m/z: 180.02 (100.0%), 181.03 (9.9%), 182.02 (4.5%)

 

InChI:InChI=1S/C9H8O2S/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5,10H,3-4H2

InChI Key:LRYHSQOHSHNSBD-UHFFFAOYSA-N

Canonical SMILES:C1CSC2=C(C1=O)C=C(C=C2)O

Specification

98%
References

Faming Zhuanli Shenqing (2015), CN 104710438 A 20150617.                                 

ACS Medicinal Chemistry Letters (2012), 3(6), 450-453.
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