Chemical Properties of Ethyl alpha-isocyanato gamma-thiomethyl butyrate (CAS 52632-06-1)

Ethyl alpha-isocyanato gamma-thiomethyl butyrate

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InChI
InChI=1S/C8H13NO3S/c1-3-12-8(11)7(9-6-10)4-5-13-2/h7H,3-5H2,1-2H3
InChI Key
IWXRXGRHXXLVHJ-UHFFFAOYSA-N
Formula
C8H13NO3S
SMILES
CCOC(=O)C(CCSC)N=C=O
Molecular Weight1
203.26
CAS
52632-06-1
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Physical Properties

Property Value Unit Source
ΔfH°gas -422.07 kJ/mol Joback Calculated Property
ΔvapH° 58.52 kJ/mol Joback Calculated Property
log10WS -5.53 Crippen Calculated Property
logPoct/wat 1.007 Crippen Calculated Property
McVol 154.620 ml/mol McGowan Calculated Property
Pc 2950.48 kPa Joback Calculated Property
Tboil 593.74 K Joback Calculated Property
Tc 799.36 K Joback Calculated Property

Similar Compounds

Ethyl 2-isocyanato-4-methylthiobutyrate. Methyl 2-isothiocyanato-4-(methylthio)butyrate. Cystathionine, N,N'-bis(dimethylaminomethylene)-, diethyl ester. L-Cystathionine, N,N'-bis(dimethylaminomethylene)-, diethyl ester. 2-Isothiocyanato-butyric acid ethyl ester. L-Homocystine, N,N'-bis(dimethylaminomethylene)-, diethyl ester. L-Cystathionine, N,N'-bis(dimethylaminomethylene)-, dimethyl ester. Cystathionine, N,N'-bis(dimethylaminomethylene)-, dimethyl ester. L-Methionine, N-chlorodifluoroacetyl-, ethyl ester. l-Methionine, n-pentafluoropropionyl-, ethyl ester. L-Methionine, methyl ester. L-Methionine, N-(trifluoroacetyl)-, butyl ester. Butric acid, 2-benzamido-4[(carboxymethyl)thio]-, dimethyl ester. DL-Methionine, N-acetyl-, ethyl ester. l-Methionine, n-pentafluoropropionyl-, butyl ester.

Find more compounds similar to Ethyl alpha-isocyanato gamma-thiomethyl butyrate.

Sources

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