Chemical Properties of 2-Butenoic acid, 2-methyl-, 2-methylpropyl ester (CAS 66917-61-1)

2-Butenoic acid, 2-methyl-, 2-methylpropyl ester

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InChI
InChI=1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h5,7H,6H2,1-4H3/b8-5+
InChI Key
XDEGQMQKHFPBEW-VMPITWQZSA-N
Formula
C9H16O2
SMILES
CC=C(C)C(=O)OCC(C)C
Molecular Weight1
156.22
CAS
66917-61-1
Other Names
  • Isobutyl 2-methyl-2-butenoate
  • Isobutyl tiglate
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Physical Properties

Property Value Unit Source
Δf -139.79 kJ/mol Joback Calculated Property
Δfgas -371.74 kJ/mol Joback Calculated Property
Δfus 17.22 kJ/mol Joback Calculated Property
Δvap 44.43 kJ/mol Joback Calculated Property
log10WS -2.06 Crippen Calculated Property
logPoct/wat 2.152 Crippen Calculated Property
McVol 140.810 ml/mol McGowan Calculated Property
Pc 2574.11 kPa Joback Calculated Property
Inp [1076.00; 1098.00]   Show Hide
Inp 1090.00 NIST
Inp 1098.00 NIST
Inp 1097.00 NIST
Inp Outlier 1076.00 NIST
Inp 1098.00 NIST
Inp 1090.00 NIST
Inp 1097.00 NIST
I [1357.00; 1364.00]   Show Hide
I 1364.00 NIST
I 1357.00 NIST
I 1357.00 NIST
I 1364.00 NIST
Tboil 485.21 K Joback Calculated Property
Tc 674.06 K Joback Calculated Property
Tfus 229.31 K Joback Calculated Property
Vc 0.538 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [306.09; 378.31] J/mol×K [485.21; 674.06] Show Hide
Cp,gas 306.09 J/mol×K 485.21 Joback Calculated Property
Cp,gas 319.56 J/mol×K 516.68 Joback Calculated Property
Cp,gas 332.44 J/mol×K 548.16 Joback Calculated Property
Cp,gas 344.74 J/mol×K 579.63 Joback Calculated Property
Cp,gas 356.48 J/mol×K 611.11 Joback Calculated Property
Cp,gas 367.66 J/mol×K 642.58 Joback Calculated Property
Cp,gas 378.31 J/mol×K 674.06 Joback Calculated Property

Similar Compounds

2-Methyl propyl 2-methyl 2-butenoate. 2-Butenoic acid, 2-methyl-, 2-methylpropyl ester, (E)-. Isobutyl angelate. 2-Butenoic acid, 2-methyl-, propyl ester, (E)-. Propyl angelate. Neopentyl (E)-2-methylbut-2-enoate. 2-Propenoic acid, 2-methyl-, 2-methylpropyl ester. 2-Methylbutyl angelate. Propane-1,3-diyl bis((E)-2-methylbut-2-enoate). n-Butyl tiglate. 2-Butenoic acid, 2-methyl-, butyl ester, (Z)-. 2-Butenoic acid, 2-methylpropyl ester. 2-Ethylbutyl (E)-2-methylbut-2-enoate. But-3-enyl (E)-2-methylbut-2-enoate. 3-Methylbutan-2-yl (E)-2-methylbut-2-enoate.

Find more compounds similar to 2-Butenoic acid, 2-methyl-, 2-methylpropyl ester.

Sources

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