Chemical Properties of Propanoic acid, 2-methyl-, 1-methylethyl ester (CAS 617-50-5)

Propanoic acid, 2-methyl-, 1-methylethyl ester

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InChI
InChI=1S/C7H14O2/c1-5(2)7(8)9-6(3)4/h5-6H,1-4H3
InChI Key
WVRPFQGZHKZCEB-UHFFFAOYSA-N
Formula
C7H14O2
SMILES
CC(C)OC(=O)C(C)C
Molecular Weight1
130.18
CAS
617-50-5
Other Names
  • ISO-PROPYL ISO-BUTYRATE
  • Isobutyric acid, isopropyl ester
  • Isopropyl 2-methylpropanoate
  • Isopropyl isobutanoate
  • Isopropyl isobutyrate
  • UN 2406
  • iso-C3H7C(O)OCH(CH3)2
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Physical Properties

Property Value Unit Source
Δf -230.74 kJ/mol Joback Calculated Property
Δfgas -443.17 kJ/mol Joback Calculated Property
Δfus 9.63 kJ/mol Joback Calculated Property
Δvap 39.56 kJ/mol Joback Calculated Property
log10WS -1.49 Crippen Calculated Property
logPoct/wat 1.594 Crippen Calculated Property
McVol 116.930 ml/mol McGowan Calculated Property
Pc 2992.59 kPa Joback Calculated Property
Inp [780.00; 785.00]   Show Hide
Inp 783.00 NIST
Inp 780.00 NIST
Inp 784.00 NIST
Inp 785.00 NIST
Inp 785.00 NIST
Inp 780.00 NIST
Inp 780.00 NIST
I [959.00; 959.00]   Show Hide
I 959.00 NIST
I 959.00 NIST
Tboil 393.90 K NIST
Tc 619.42 K Joback Calculated Property
Tfus 210.81 K Joback Calculated Property
Vc 0.440 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [238.81; 303.21] J/mol×K [434.97; 619.42] Show Hide
Cp,gas 238.81 J/mol×K 434.97 Joback Calculated Property
Cp,gas 250.59 J/mol×K 465.71 Joback Calculated Property
Cp,gas 261.96 J/mol×K 496.45 Joback Calculated Property
Cp,gas 272.90 J/mol×K 527.19 Joback Calculated Property
Cp,gas 283.42 J/mol×K 557.94 Joback Calculated Property
Cp,gas 293.53 J/mol×K 588.68 Joback Calculated Property
Cp,gas 303.21 J/mol×K 619.42 Joback Calculated Property
η [0.0002432; 0.0077039] Pa×s [210.81; 434.97] Show Hide
η 0.0077039 Pa×s 210.81 Joback Calculated Property
η 0.0028076 Pa×s 248.17 Joback Calculated Property
η 0.0013326 Pa×s 285.53 Joback Calculated Property
η 0.0007515 Pa×s 322.89 Joback Calculated Property
η 0.0004773 Pa×s 360.25 Joback Calculated Property
η 0.0003301 Pa×s 397.61 Joback Calculated Property
η 0.0002432 Pa×s 434.97 Joback Calculated Property
ΔvapH 43.30 kJ/mol 325.50 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [0.14; 102.66] kPa [257.15; 394.15] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A1.07810e+02
Coefficient B-8.48658e+03
Coefficient C-1.39917e+01
Coefficient D1.27287e-05
Temperature range, min.257.15
Temperature range, max.394.15
Pvap 0.14 kPa 257.15 Calculated Property
Pvap 0.42 kPa 272.37 Calculated Property
Pvap 1.15 kPa 287.59 Calculated Property
Pvap 2.76 kPa 302.82 Calculated Property
Pvap 5.99 kPa 318.04 Calculated Property
Pvap 11.96 kPa 333.26 Calculated Property
Pvap 22.22 kPa 348.48 Calculated Property
Pvap 38.87 kPa 363.71 Calculated Property
Pvap 64.57 kPa 378.93 Calculated Property
Pvap 102.66 kPa 394.15 Calculated Property

Similar Compounds

Isobutyric acid, tert-butyl ester. Propanoic acid, 2-methyl-, ethyl ester. Propanoic acid, 1-methylethyl ester. tert-C4H9C(O)OCH(CH3)2. Propanoic acid, 2-methyl-, 1-methylpropyl ester. Butanoic acid, 2-methyl-, 1-methylethyl ester. Propanoic acid, 2-methyl-, propyl ester. Propionic acid, 2-chloro-, isopropyl ester. Ethanol, 2-bromo, 2-methylpropyl ester. Isopropyl butyrate. Succinic acid diisopropyl ester. Propanoic acid, 2-methyl, 2-iodoethyl ester. Isopropyl 2-bromopropanoate. Propanoic acid, 3-chloro-, 1-methylethyl ester. Ethanol, 2-chloro, 2-methylpropanoate.

Find more compounds similar to Propanoic acid, 2-methyl-, 1-methylethyl ester.

Sources

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