Chemical Properties of 2-Heptenal (CAS 2463-63-0)

2-Heptenal

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InChI
InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3
InChI Key
NDFKTBCGKNOHPJ-UHFFFAOYSA-N
Formula
C7H12O
SMILES
CCCCC=CC=O
Molecular Weight1
112.17
CAS
2463-63-0
Other Names
  • 2-Hepten-1-al
  • hept-2-enal
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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 [909.00; 975.00]   Show Hide
Inp 935.00 NIST
Inp 945.00 NIST
Inp 951.00 NIST
Inp 948.00 NIST
Inp 960.00 NIST
Inp 963.00 NIST
Inp 959.00 NIST
Inp 963.00 NIST
Inp 952.00 NIST
Inp 940.00 NIST
Inp 968.00 NIST
Inp 936.00 NIST
Inp 927.00 NIST
Inp 930.00 NIST
Inp 957.00 NIST
Inp 951.00 NIST
Inp 962.00 NIST
Inp 970.00 NIST
Inp 941.00 NIST
Inp Outlier 909.00 NIST
Inp 952.00 NIST
Inp 964.00 NIST
Inp 959.00 NIST
Inp 958.00 NIST
Inp 954.00 NIST
Inp 956.00 NIST
Inp 963.00 NIST
Inp 975.00 NIST
Inp 961.00 NIST
Inp 940.00 NIST
Inp 957.00 NIST
Inp 928.00 NIST
Inp 926.00 NIST
Inp 956.00 NIST
Inp 959.00 NIST
Inp 961.00 NIST
Inp 931.00 NIST
Inp Outlier 921.00 NIST
Inp 957.00 NIST
Inp 960.00 NIST
Inp 941.00 NIST
Inp 949.00 NIST
Inp 963.00 NIST
Inp 960.00 NIST
Inp 948.00 NIST
Inp 932.00 NIST
Inp 952.00 NIST
Inp 956.00 NIST
Inp 957.00 NIST
Inp 960.00 NIST
Inp 935.00 NIST
I [1313.00; 1364.00]   Show Hide
I Outlier 1364.00 NIST
I 1352.00 NIST
I 1321.00 NIST
I 1320.00 NIST
I 1313.00 NIST
I 1353.00 NIST
I 1327.00 NIST
I 1333.00 NIST
I 1334.00 NIST
I 1349.00 NIST
I 1320.00 NIST
I 1336.00 NIST
I 1338.00 NIST
I 1336.00 NIST
I 1336.00 NIST
I 1337.00 NIST
I 1338.00 NIST
I 1320.00 NIST
I 1327.00 NIST
I 1313.00 NIST
I 1352.00 NIST
I 1333.00 NIST
I 1338.00 NIST
I 1353.00 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

2-Heptenal, (Z)-. 2-Heptenal, (E)-. [2,3-2H2]-(E)-2-Octenal. 2-Octenal, (E)-. (Z)-2-octenal. 2-Octenal. 2-Nonenal, (Z)-. 2-Nonenal, (E)-. 2-Nonenal. 2-Dodecenal, (E)-. 2-Undecenal, E-. 2-Tridecenal, (E)-. (E)-2-pentadecenal. 2-Decenal, (E)-. (E)-2-tetradecenal.

Find more compounds similar to 2-Heptenal.

Sources

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