Chemical Properties of 3-Ethylthio-1-propene (CAS 5296-62-8)

3-Ethylthio-1-propene

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InChI
InChI=1S/C5H10S/c1-3-5-6-4-2/h3H,1,4-5H2,2H3
InChI Key
NOJXPGXFDASWEI-UHFFFAOYSA-N
Formula
C5H10S
SMILES
C=CCSCC
Molecular Weight1
102.20
CAS
5296-62-8
Other Names
  • 4-Thia-1-hexene
  • Allyl ethyl sulfide
  • Allyl ethyl sulphide
  • CH2=CHCH2SC2H5
Sources

Physical Properties

Property Value Unit Source
Δcliquid -3977.40 ± 1.90 kJ/mol NIST
Δf 112.18 kJ/mol Joback Calculated Property
Δfgas 18.00 ± 3.00 kJ/mol NIST
Δfliquid -21.00 ± 3.00 kJ/mol NIST
Δfus 11.56 kJ/mol Joback Calculated Property
Δvap 39.30 kJ/mol NIST
Δvap 39.00 ± 1.00 kJ/mol NIST
Δvap 39.00 kJ/mol NIST
IE 8.51 ± 0.01 eV NIST
logPoct/wat 1.93 Crippen Calculated Property
Pc 3722.56 kPa Joback Calculated Property
Tboil 379.26 K Joback Calculated Property
Tc 573.61 K Joback Calculated Property
Tfus 178.75 K Joback Calculated Property
Vc 0.35 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 155.70 J/mol×K 379.26 Joback Calculated Property
ΔvapH 38.90 kJ/mol 313.5 NIST

Molecular Descriptors

Joback and Reid Groups
-S- 1
-CH3 1
-CH2- 2
=CH2 1
=CH- 1

Similar Compounds

1-Propene, 3,3'-thiobis-. 1-Propene, 3-(methylthio)-. 2-Butene, 2-(ethylthio)-, (Z)-. 3-Thia-5-hexene-1-thiol. 1-(Ethylthiomethyl)propene. trans-1-(Ethylthio)-2-butene. Thiophene, 2,5-dihydro-. 1-Propene, 3-[(1-methylethyl)thio]-. CH3CH2CH2SCH2CH=CH2. (allylthio)acetaldehyde. CH.equiv.CCH2SCH2CH=CH2. trans-1-(Methylthio)-2-butene. Sulfide, 2-butenyl methyl, cis, (Z)-. 4,7-dithia-1-octene. 4,7-dithia-1,9-decadiene.

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