Chemical Properties of Acetic acid, thio-, s-2-bromoethyl ester

Acetic acid, thio-, s-2-bromoethyl ester

InChI
InChI=1S/C4H7BrOS/c1-4(6)7-3-2-5/h2-3H2,1H3
InChI Key
NYHLAZJBJZRGPV-UHFFFAOYSA-N
Formula
C4H7BrOS
SMILES
CC(=O)SCCBr
Molecular Weight1
183.07
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Physical Properties

Property Value Unit Source
ΔfH°gas -208.63 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 17.13 kJ/mol Joback Calculated Property
ΔvapH° 53.61 kJ/mol Relay (1.0) Calculated Property
IE 9.71 eV Relay (1.0) Calculated Property
logPoct/wat 1.661 Crippen Calculated Property
McVol 102.640 ml/mol McGowan Calculated Property
Pc 4736.62 kPa Joback Calculated Property
Tboil 468.21 K Relay (1.0) Calculated Property
Tc 677.99 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [177.04; 217.40] J/mol×K [479.93; 703.89] Show Hide
Cp,gas 177.04 J/mol×K 479.93 Joback Calculated Property
Cp,gas 184.80 J/mol×K 517.26 Joback Calculated Property
Cp,gas 192.13 J/mol×K 554.58 Joback Calculated Property
Cp,gas 199.05 J/mol×K 591.91 Joback Calculated Property
Cp,gas 205.56 J/mol×K 629.24 Joback Calculated Property
Cp,gas 211.67 J/mol×K 666.56 Joback Calculated Property
Cp,gas 217.40 J/mol×K 703.89 Joback Calculated Property

Similar Compounds

S-Ethyl ethanethioate. Ethanethioic acid, S-propyl ester. Thiopropionic acid, S-ethyl ester. Ethanethioic acid, (methylthio)-s-ethyl ester. allyl thioacetate. Ethanethioic acid, S-(1-methylethyl) ester. 2-[Ethylthio]ethanal. Ethanethioic acid, trifluoro-, S-ethyl ester. Ethanethioic acid, S-(2-methylpropyl) ester. Propanethioic acid, S-propyl ester. Diethyl dithiol oxalate. Ethanethioic acid, S-butyl ester. Diethyl sulfide. 2-Chloroethyl ethyl sulfide. 2-[Isopropylthio]ethanal.

Find more compounds similar to Acetic acid, thio-, s-2-bromoethyl ester.

Sources

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