Chemical Properties of 2-Nonylidene-1,3-dithiolane

2-Nonylidene-1,3-dithiolane

InChI
InChI=1S/C12H22S2/c1-2-3-4-5-6-7-8-9-12-13-10-11-14-12/h9H,2-8,10-11H2,1H3
InChI Key
QTRGCABSLUYSHT-UHFFFAOYSA-N
Formula
C12H22S2
SMILES
CCCCCCCCC=C1SCCS1
Molecular Weight1
230.43
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Physical Properties

Property Value Unit Source
ΔfusH° 27.34 kJ/mol Joback Calculated Property
logPoct/wat 5.058 Crippen Calculated Property
McVol 197.480 ml/mol McGowan Calculated Property
Inp [1823.00; 1823.00]   Show Hide
Inp 1823.00 NIST
Inp 1823.00 NIST
Tboil 580.69 K Relay (1.0) Calculated Property
Tfus 282.99 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [265.95; 633.74] 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 A-1.97030e+01
Coefficient B1.25334e+00
Coefficient C-8.17700e-04
Coefficient D2.17800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 265.95 J/mol×K 273.00 Calculated Property
Cp,gas 331.00 J/mol×K 353.78 Calculated Property
Cp,gas 388.40 J/mol×K 434.56 Calculated Property
Cp,gas 438.84 J/mol×K 515.33 Calculated Property
Cp,gas 482.99 J/mol×K 596.11 Calculated Property
Cp,gas 521.56 J/mol×K 676.89 Calculated Property
Cp,gas 555.23 J/mol×K 757.67 Calculated Property
Cp,gas 584.69 J/mol×K 838.44 Calculated Property
Cp,gas 610.63 J/mol×K 919.22 Calculated Property
Cp,gas 633.74 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-Heptadecylidene-1,3-dithiolane. 2-Pentadecylidene-1,3-dithiolane. 2-Hexadecylidene-1,3-dithiolane. 2-Butylidene-1,3-dithiolane. 2,4-Bis(hexylthio)but-2-enal. Naphtho[1,2-b]thiophene, 4-methyl. 2,4-Bis(pentylthio)bute-2-nal. 4,5-dimethyl-2-(1-octenyl)-3-thiazoline, cis. 4,5-dimethyl-2-(1-octenyl)-3-thiazoline, trans. 2-Pentyl-2H-thiapyrane. 2-Hexyl-2H-thiapyrane. 6,7-dihydronerolidol. Caryophylla-2(12),6-dien-5 «beta»-ol (=Caryophylladienol II). Caryophylla-2(12),6-dien-5 «alpha»-ol (=Caryophylladienol I). 2,4-Dibutyl-2,5-dihydro-thiophene.

Find more compounds similar to 2-Nonylidene-1,3-dithiolane.

Sources

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