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Structure

Benzo[c]thiophene-1-carboxylicacid,4,5,6,7-tetrahydro-4-hydroxy-3-(methylthio)-,ethyl ester

CAS
172516-36-8
Catalog Number
ACM172516368
Category
Other Products
Molecular Weight
272.38
Molecular Formula
C12H16O3S2

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Specification

Synonyms
HMS554J08;
IUPAC Name
ethyl 4-hydroxy-3-methylsulfanyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate
Canonical SMILES
CCOC(=O)C1=C2CCCC(C2=C(S1)SC)O
InChI Key
RBCWUWDOOSYVAH-UHFFFAOYSA-N
Boiling Point
429.1ºC at 760mmHg
Melting Point
119ºC
Flash Point
213.3ºC
Density
1.31g/cm³
Exact Mass
272.05400
H-Bond Acceptor
5
H-Bond Donor
1
Safety Description
S24/25
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