Chemical Properties of 1-Butene, 3-methyl-2-(1-methylpropoxy)- (CAS 56798-16-4)

1-Butene, 3-methyl-2-(1-methylpropoxy)-

InChI
InChI=1S/C9H18O/c1-6-8(4)10-9(5)7(2)3/h7-8H,5-6H2,1-4H3
InChI Key
XAJRFKUYOLUIIB-UHFFFAOYSA-N
Formula
C9H18O
SMILES
C=C(OC(C)CC)C(C)C
Molecular Weight1
142.24
CAS
56798-16-4
Other Names
  • 2-Sec-butoxy-3-methyl-1-butene
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Physical Properties

Property Value Unit Source
ω 0.4192 Relay (1.0) Calculated Property
ΔfH°gas -321.03 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 10.62 kJ/mol Joback Calculated Property
ΔvapH° 41.70 kJ/mol Relay (1.0) Calculated Property
IE 8.31 eV Relay (1.0) Calculated Property
logPoct/wat 2.971 Crippen Calculated Property
McVol 139.240 ml/mol McGowan Calculated Property
Pc 2412.37 kPa Joback Calculated Property
Tboil 397.47 K Relay (1.0) Calculated Property
Tc 575.24 K Relay (1.0) Calculated Property
Tfus 192.70 K Relay (1.0) Calculated Property
Vc 0.525 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, 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 [201.52; 474.44] 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 A1.41610e+01
Coefficient B7.87380e-01
Coefficient C-3.86400e-04
Coefficient D5.93000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 201.52 J/mol×K 273.00 Calculated Property
Cp,gas 246.98 J/mol×K 353.78 Calculated Property
Cp,gas 288.22 J/mol×K 434.56 Calculated Property
Cp,gas 325.42 J/mol×K 515.33 Calculated Property
Cp,gas 358.78 J/mol×K 596.11 Calculated Property
Cp,gas 388.48 J/mol×K 676.89 Calculated Property
Cp,gas 414.71 J/mol×K 757.67 Calculated Property
Cp,gas 437.65 J/mol×K 838.44 Calculated Property
Cp,gas 457.50 J/mol×K 919.22 Calculated Property
Cp,gas 474.44 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-(3-Pentoxy)-3-methyl-1-butene. 2-Isopropoxy-3-methyl-1-butene. 2-Butene,2-methyl-3-(1-methylpropoxy)-. 2-Ethoxy-3-methyl-1-butene. Pentane, 3-[(1,2-dimethyl-1-propenyl)oxy]-. 2-(2-Chloroethoxy)-3-methyl-1-butene. Furan, 2,3-dihydro-5-(1-methylethyl)-. Propanoic acid, 2-methyl-, 1-methylpropyl ester. (Z)-3-Ethoxy-4-methyl-2-pentene. (E)-3-Ethoxy-4-methyl-2-pentene. Adipic acid, isobutyl pent-4-en-2-yl ester. 2-(2-Methoxyethoxy)-3-methyl-1-butene. Glutaric acid, but-3-en-2-yl 2-methylpent-3-yl ester. Succinic acid, 3-methylbut-2-yl pent-4-en-2-yl ester. 1-(3-Pentoxy)-1,4-cyclohexadiene.

Find more compounds similar to 1-Butene, 3-methyl-2-(1-methylpropoxy)-.

Sources

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