Chemical Properties of 4-Heptenal (CAS 62238-34-0)

4-Heptenal

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InChI
InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h3-4,7H,2,5-6H2,1H3/b4-3+
InChI Key
VVGOCOMZRGWHPI-ONEGZZNKSA-N
Formula
C7H12O
SMILES
CCC=CCCC=O
Molecular Weight1
112.17
CAS
62238-34-0
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Physical Properties

Property Value Unit Source
Δf -11.24 kJ/mol Joback Calculated Property
Δfgas -156.17 kJ/mol Joback Calculated Property
Δfus 16.38 kJ/mol Joback Calculated Property
Δvap 37.85 kJ/mol Joback Calculated Property
log10WS -1.89 Crippen Calculated Property
logPoct/wat 1.932 Crippen Calculated Property
McVol 106.760 ml/mol McGowan Calculated Property
Pc 3213.68 kPa Joback Calculated Property
Inp [870.00; 919.00]   Show Hide
Inp 898.00 NIST
Inp 911.00 NIST
Inp 895.00 NIST
Inp 899.00 NIST
Inp Outlier 870.00 NIST
Inp Outlier 870.00 NIST
Inp 919.00 NIST
Inp 901.00 NIST
Inp 902.00 NIST
Inp 898.00 NIST
Inp 889.00 NIST
Inp 895.00 NIST
Inp 898.00 NIST
Inp 898.00 NIST
Inp 895.00 NIST
Inp 919.00 NIST
I [1198.00; 1252.00]   Show Hide
I 1243.00 NIST
I 1252.00 NIST
I 1198.00 NIST
I 1252.00 NIST
Tboil 412.38 K Joback Calculated Property
Tc 592.75 K Joback Calculated Property
Tfus 205.57 K Joback Calculated Property
Vc 0.424 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [201.75; 258.96] J/mol×K [412.38; 592.75] Show Hide
Cp,gas 201.75 J/mol×K 412.38 Joback Calculated Property
Cp,gas 212.47 J/mol×K 442.44 Joback Calculated Property
Cp,gas 222.70 J/mol×K 472.50 Joback Calculated Property
Cp,gas 232.44 J/mol×K 502.57 Joback Calculated Property
Cp,gas 241.72 J/mol×K 532.63 Joback Calculated Property
Cp,gas 250.55 J/mol×K 562.69 Joback Calculated Property
Cp,gas 258.96 J/mol×K 592.75 Joback Calculated Property
η [0.0002654; 0.0042661] Pa×s [205.57; 412.38] Show Hide
η 0.0042661 Pa×s 205.57 Joback Calculated Property
η 0.0019261 Pa×s 240.04 Joback Calculated Property
η 0.0010618 Pa×s 274.51 Joback Calculated Property
η 0.0006685 Pa×s 308.98 Joback Calculated Property
η 0.0004619 Pa×s 343.44 Joback Calculated Property
η 0.0003414 Pa×s 377.91 Joback Calculated Property
η 0.0002654 Pa×s 412.38 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [328.32; 458.31] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.55564e+01
Coefficient B-4.04756e+03
Coefficient C-6.32340e+01
Temperature range, min.328.32
Temperature range, max.458.31
Pvap 1.33 kPa 328.32 Calculated Property
Pvap 2.93 kPa 342.76 Calculated Property
Pvap 5.98 kPa 357.21 Calculated Property
Pvap 11.39 kPa 371.65 Calculated Property
Pvap 20.49 kPa 386.09 Calculated Property
Pvap 35.05 kPa 400.54 Calculated Property
Pvap 57.36 kPa 414.98 Calculated Property
Pvap 90.31 kPa 429.42 Calculated Property
Pvap 137.37 kPa 443.87 Calculated Property
Pvap 202.64 kPa 458.31 Calculated Property

Similar Compounds

(E)-4-Heptenal. (Z)-4-Heptenal. 4-Heptenal, (Z)-. 4-Heptenal, (E)-. 4-Nonenal, (E)-. 4-nonenal. Dec-4-enal. cis-4-Decenal. 4-Decenal, (E)-. cis-Undec-4-enal. trans-Undec-4-enal. 4-dodecenal, E. 4-hexadecenal, Z. Tangerinal 2. 4-dodecenal, Z.

Find more compounds similar to 4-Heptenal.

Sources

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