Chemical Properties of 2-(Heptylsulfanyl)ethanol

2-(Heptylsulfanyl)ethanol

InChI
InChI=1S/C9H20OS/c1-2-3-4-5-6-8-11-9-7-10/h10H,2-9H2,1H3
InChI Key
SFQDKASLZODHCY-UHFFFAOYSA-N
Formula
C9H20OS
SMILES
CCCCCCCSCCO
Molecular Weight1
176.33
Other Names
  • Ethanol, 2-(heptylthio)-
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Physical Properties

Property Value Unit Source
ω 0.7417 Relay (1.0) Calculated Property
ΔfG° -78.80 kJ/mol Joback Calculated Property
ΔfH°gas -367.00 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 27.28 kJ/mol Joback Calculated Property
ΔvapH° 84.47 kJ/mol Relay (1.0) Calculated Property
IE 8.93 eV Relay (1.0) Calculated Property
log10WS -2.67 Relay (1.0) Calculated Property
logPoct/wat 2.682 Crippen Calculated Property
McVol 159.890 ml/mol McGowan Calculated Property
Pc 2568.89 kPa Joback Calculated Property
Tboil 537.89 K Relay (1.0) Calculated Property
Tc 746.88 K Relay (1.0) Calculated Property
Tfus 261.59 K Relay (1.0) Calculated Property
Vc 0.586 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [229.41; 528.91] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A1.95980e+01
Coefficient B8.87210e-01
Coefficient C-4.56000e-04
Coefficient D7.81000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 229.41 J/mol×K 273.00 Calculated Property
Cp,gas 279.86 J/mol×K 353.78 Calculated Property
Cp,gas 325.44 J/mol×K 434.56 Calculated Property
Cp,gas 366.40 J/mol×K 515.33 Calculated Property
Cp,gas 402.98 J/mol×K 596.11 Calculated Property
Cp,gas 435.43 J/mol×K 676.89 Calculated Property
Cp,gas 464.01 J/mol×K 757.67 Calculated Property
Cp,gas 488.94 J/mol×K 838.44 Calculated Property
Cp,gas 510.50 J/mol×K 919.22 Calculated Property
Cp,gas 528.91 J/mol×K 1000.00 Calculated Property

Similar Compounds

Ethanol, 2-(octylthio)-. Ethanol, 2-hexadecylthio-. 2-Hydroxyethyl hexyl sulfide. Heptane, 1,1'-thiobis-. 6-Thiatridecane. Decyl sulfide. 5-Thiadodecane. 6-Thiatetradecane. Undecyl sulfide. Octane, 1,1'-thiobis-. di-n-Nonyl sulfide. Dodecane, 1,1'-thiobis-. heptyl propyl sulfide. Octane, 1-(butylthio)-. Ethanol, 2,2'-[1,4-butanediylbis(thio)]bis-.

Find more compounds similar to 2-(Heptylsulfanyl)ethanol.

Sources

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