Chemical Properties of Ethyl 5,6-Epoxyhexanoate

Ethyl 5,6-Epoxyhexanoate

InChI
InChI=1S/C8H14O3/c1-2-10-8(9)5-3-4-7-6-11-7/h7H,2-6H2,1H3
InChI Key
IMJURUKQBKWFLX-UHFFFAOYSA-N
Formula
C8H14O3
SMILES
CCOC(=O)CCCC1CO1
Molecular Weight1
158.19
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Physical Properties

Property Value Unit Source
ω 0.5465 Relay (1.0) Calculated Property
ΔfG° -319.26 kJ/mol Joback Calculated Property
ΔfH°gas -567.43 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 26.96 kJ/mol Joback Calculated Property
ΔvapH° 62.94 kJ/mol Relay (1.0) Calculated Property
IE 9.79 eV Relay (1.0) Calculated Property
log10WS -0.79 Relay (1.0) Calculated Property
logPoct/wat 1.119 Crippen Calculated Property
McVol 126.030 ml/mol McGowan Calculated Property
Pc 2890.51 kPa Joback Calculated Property
Inp 1214.00 NIST
Tboil 485.20 K Relay (1.0) Calculated Property
Tc 666.35 K Relay (1.0) Calculated Property
Tfus 232.61 K Relay (1.0) Calculated Property
Vc 0.504 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [185.45; 439.42] 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-1.18960e+01
Coefficient B8.56920e-01
Coefficient C-5.23100e-04
Coefficient D1.17500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 185.45 J/mol×K 273.00 Calculated Property
Cp,gas 231.00 J/mol×K 353.78 Calculated Property
Cp,gas 271.34 J/mol×K 434.56 Calculated Property
Cp,gas 306.87 J/mol×K 515.33 Calculated Property
Cp,gas 337.93 J/mol×K 596.11 Calculated Property
Cp,gas 364.91 J/mol×K 676.89 Calculated Property
Cp,gas 388.18 J/mol×K 757.67 Calculated Property
Cp,gas 408.11 J/mol×K 838.44 Calculated Property
Cp,gas 425.06 J/mol×K 919.22 Calculated Property
Cp,gas 439.42 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0031703; 0.0005011] Pa×s [266.76; 461.99] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.01192e+01
Coefficient B1.16447e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.266.76
Temperature range, max.461.99
η 0.0031703 Pa×s 266.76 Calculated Property
η 0.0022831 Pa×s 288.45 Calculated Property
η 0.0017215 Pa×s 310.15 Calculated Property
η 0.0013468 Pa×s 331.84 Calculated Property
η 0.0010859 Pa×s 353.53 Calculated Property
η 0.0008976 Pa×s 375.22 Calculated Property
η 0.0007576 Pa×s 396.92 Calculated Property
η 0.0006507 Pa×s 418.61 Calculated Property
η 0.0005674 Pa×s 440.30 Calculated Property
η 0.0005011 Pa×s 461.99 Calculated Property

Similar Compounds

Oxiraneundecanoic acid, 3-pentyl-, methyl ester, cis-. Hexanoic acid, 5-(acetyloxy)-, ethyl ester. Glutaric acid, 2-hexyl hexyl ester. ethyl 5-hydroxyhexanoate. Glutaric acid, 2-hexyl pentyl ester. Glutaric acid, 2-heptyl pentyl ester. Glutaric acid, butyl 2-hexyl ester. Glutaric acid, 2-heptyl heptyl ester. Glutaric acid, butyl 2-heptyl ester. Glutaric acid, 2-octyl pentyl ester. Glutaric acid, 2-decyl pentadecyl ester. Glutaric acid, 2-octyl pentadecyl ester. Glutaric acid, 2-heptyl tetradecyl ester. Glutaric acid, 2-heptyl octyl ester. Glutaric acid, 2-heptyl undecyl ester.

Find more compounds similar to Ethyl 5,6-Epoxyhexanoate.

Sources

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