Chemical Properties of Methyl 2-(methylthio)acetate (CAS 16630-66-3)

Methyl 2-(methylthio)acetate

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InChI
InChI=1S/C4H8O2S/c1-6-4(5)3-7-2/h3H2,1-2H3
InChI Key
HZYCAKGEXXKCDM-UHFFFAOYSA-N
Formula
C4H8O2S
SMILES
COC(=O)CSC
Molecular Weight1
120.17
CAS
16630-66-3
Other Names
  • Acetic acid, (methylthio)-, methyl ester
  • Methyl (methylithio)acetate
  • Methyl methylthioacetate
Sources

Physical Properties

Property Value Unit Source
Δf -218.00 kJ/mol Joback Calculated Property
Δfgas -328.82 kJ/mol Joback Calculated Property
Δfus 13.03 kJ/mol Joback Calculated Property
Δvap 40.47 kJ/mol Joback Calculated Property
logPoct/wat 0.52 Crippen Calculated Property
Pc 4222.04 kPa Joback Calculated Property
Tboil 435.99 K Joback Calculated Property
Tc 640.35 K Joback Calculated Property
Tfus 241.40 K Joback Calculated Property
Vc 0.34 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 167.75 J/mol×K 435.99 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-S- 1
>C=O (nonring) 1
-CH2- 1
-CH3 2

Similar Compounds

Ethyl(methylthio)acetate. Acetic acid, mercapto-, methyl ester. 2-Methylthioacetic acid. Methyl allylthioacetate. Acetic acid, mercapto-, ethyl ester. 2-(methylthio)ethyl acetate. Thiodiglycolic anhydride. Acetic acid, 2-mercaptoethyl ester. 2-Sulfanylethyl acetate. Acetic acid, (2-propenylthio)-. Methylenebis(ethyl thioglycolate). Methyl alpha-mercaptopropionate. Ethanol, 2,2'-thiobis-, diacetate. Acetic acid, mercapto-. Dimethyl 3-thiaadipate.

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