Chemical Properties of Sulfide, ethyl propyl (CAS 4110-50-3)

Sulfide, ethyl propyl

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InChI
InChI=1S/C5H12S/c1-3-5-6-4-2/h3-5H2,1-2H3
InChI Key
ZDDDFDQTSXYYSE-UHFFFAOYSA-N
Formula
C5H12S
SMILES
CCCSCC
Molecular Weight1
104.21
CAS
4110-50-3
Other Names
  • 1-(ETHYLTHIO)PROPANE
  • 3-THIAHEXANE
  • ETHYL PROPYL THIO ETHER
  • Ethyl n-propyl sulfide
  • Ethyl propyl sulfide
  • Ethyl propyl sulphide
  • Ethyl propyl thioether
  • Propane, 1-(ethylthio)-
  • Propyl ethyl sulfide
  • n-C3H7SC2H5
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Physical Properties

Property Value Unit Source
Δcliquid [-4139.90; -4139.50] kJ/mol Show
Δcliquid -4139.90 ± 0.59 kJ/mol NIST
Δcliquid -4139.50 ± 0.59 kJ/mol NIST
Δf 24.34 kJ/mol Joback Calculated Property
Δfgas [-104.70; -104.50] kJ/mol Show
Δfgas -104.70 ± 0.79 kJ/mol NIST
Δfgas -104.50 kJ/mol NIST
Δfliquid [-144.80; -144.60] kJ/mol Show
Δfliquid -144.80 ± 0.79 kJ/mol NIST
Δfliquid -144.60 ± 0.75 kJ/mol NIST
Δfus 12.84 kJ/mol Joback Calculated Property
Δvap [39.50; 40.10] kJ/mol Show
Δvap 40.01 kJ/mol NIST
Δvap Outlier 39.50 kJ/mol NIST
Δvap 40.00 kJ/mol NIST
Δvap 40.10 ± 0.04 kJ/mol NIST
Δvap 40.10 kJ/mol NIST
Δvap 40.08 kJ/mol NIST
IE [8.37; 8.50] eV Show
IE 8.37 eV NIST
IE 8.50 ± 0.05 eV NIST
log10WS -1.80 Crippen Calculated Property
logPoct/wat 2.150 Crippen Calculated Property
McVol 97.660 ml/mol McGowan Calculated Property
Pc 3538.87 kPa Joback Calculated Property
Inp [782.00; 801.00]   Show
Inp 794.00 NIST
Inp 794.00 NIST
Inp 801.00 NIST
Inp 785.00 NIST
Inp 785.00 NIST
Inp 782.00 NIST
Inp 783.00 NIST
Inp 785.00 NIST
Inp 794.00 NIST
I [1017.00; 1017.00]   Show
I 1017.00 NIST
I 1017.00 NIST
liquid 309.53 J/mol×K NIST
Tboil [389.00; 391.70] K Show
Tboil 391.70 K NIST
Tboil 391.70 K NIST
Tboil 391.70 ± 0.30 K NIST
Tboil 389.00 ± 3.00 K NIST
Tc 572.69 K Joback Calculated Property
Tfus 156.11 ± 0.10 K NIST
Ttriple [156.10; 156.10] K Show
Ttriple 156.10 ± 0.04 K NIST
Ttriple 156.10 ± 0.03 K NIST
Vc 0.369 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [169.71; 224.63] J/mol×K [382.58; 572.69] Show
T(K)
Ideal gas heat capacity (J/mol×K)
170
180
190
200
210
220
230
400
450
500
550
Cp,gas 169.71 J/mol×K 382.58 Joback Calculated Property
Cp,gas 179.76 J/mol×K 414.26 Joback Calculated Property
Cp,gas 189.45 J/mol×K 445.95 Joback Calculated Property
Cp,gas 198.78 J/mol×K 477.63 Joback Calculated Property
Cp,gas 207.75 J/mol×K 509.32 Joback Calculated Property
Cp,gas 216.36 J/mol×K 541.00 Joback Calculated Property
Cp,gas 224.63 J/mol×K 572.69 Joback Calculated Property
Cp,liquid 198.41 J/mol×K 298.15 NIST
ΔfusH [10.58; 10.58] kJ/mol [156.10; 156.10] Show
ΔfusH 10.58 kJ/mol 156.10 NIST
ΔfusH 10.58 kJ/mol 156.10 NIST
ΔfusH 10.58 kJ/mol 156.10 NIST
ΔvapH [34.24; 39.80] kJ/mol [355.50; 391.70] Show
ΔvapH 39.80 kJ/mol 355.50 NIST
ΔvapH 37.80 kJ/mol 364.50 NIST
ΔvapH 34.24 kJ/mol 391.70 NIST
ΔfusS 67.78 J/mol×K 156.10 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [287.68; 417.73] The Yaw... Show
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.42227e+01
Coefficient B-3.21450e+03
Coefficient C-5.70070e+01
Temperature range, min.287.68
Temperature range, max.417.73
T(K)
Vapor pressure (kPa)
0
50
100
150
200
300
350
400
Pvap 1.33 kPa 287.68 Calculated Property
Pvap 3.03 kPa 302.13 Calculated Property
Pvap 6.29 kPa 316.58 Calculated Property
Pvap 12.08 kPa 331.03 Calculated Property
Pvap 21.75 kPa 345.48 Calculated Property
Pvap 37.00 kPa 359.93 Calculated Property
Pvap 59.99 kPa 374.38 Calculated Property
Pvap 93.25 kPa 388.83 Calculated Property
Pvap 139.70 kPa 403.28 Calculated Property
Pvap 202.63 kPa 417.73 Calculated Property
Pvap [1.37; 3391.50] kPa [287.15; 584.00] KDB Vap... Show
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A9.12345e+01
Coefficient B-7.82974e+03
Coefficient C-1.13601e+01
Coefficient D7.81191e-06
Temperature range, min.287.15
Temperature range, max.584.00
T(K)
Vapor pressure (kPa)
0
500
1000
1500
2000
2500
3000
3500
300
400
500
Pvap 1.37 kPa 287.15 Calculated Property
Pvap 7.72 kPa 320.13 Calculated Property
Pvap 29.60 kPa 353.12 Calculated Property
Pvap 86.33 kPa 386.10 Calculated Property
Pvap 206.53 kPa 419.08 Calculated Property
Pvap 427.27 kPa 452.07 Calculated Property
Pvap 793.63 kPa 485.05 Calculated Property
Pvap 1360.34 kPa 518.03 Calculated Property
Pvap 2196.17 kPa 551.02 Calculated Property
Pvap 3391.50 kPa 584.00 Calculated Property

Similar Compounds

Propyl sulfide. Propane, 1,3-bis(ethylthio)-. Propane, 1-[(1-methylethyl)thio]-. 2,6-dithiaoctane. 2-[Propylthio]ethanal. 2,6-dithianonane. 3,6-dithianonane. Propane, 1-(methylthio)-. 4-thia-1-heptyne. Propane, 2-methyl-1-(propylthio)-. 2,5-dithiaoctane. Propane, 1-(ethylthio)-2-methyl-. 3-Thia-1-hexanethiol. Butane, 1-(ethylthio)-. t-Butyl n-propyl sulfide.

Find more compounds similar to Sulfide, ethyl propyl.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.