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Ethyl 3-Methylsulfanylbenzoate
[CAS# 1442-02-0]

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Identification
Name Ethyl 3-Methylsulfanylbenzoate
Synonyms 3-(Methylthio)Benzoic Acid Ethyl Ester; Nsc58103
Molecular Structure CAS#: 1442-02-0, Ethyl 3-Methylsulfanylbenzoate
Molecular Formula C10H12O2S
Molecular Weight 196.26
CAS Registry Number 1442-02-0
SMILES C1=CC=C(SC)C=C1C(OCC)=O
InChI 1S/C10H12O2S/c1-3-12-10(11)8-5-4-6-9(7-8)13-2/h4-7H,3H2,1-2H3
InChIKey DXATWXQPWLCGPA-UHFFFAOYSA-N
Properties
Density 1.135g/cm3 (Cal.)
Boiling point 290.772°C at 760 mmHg (Cal.)
Flash point 132.581°C (Cal.)
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