Chemical Properties of Pentanal (CAS 110-62-3)

Pentanal

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InChI
InChI=1S/C5H10O/c1-2-3-4-5-6/h5H,2-4H2,1H3
InChI Key
HGBOYTHUEUWSSQ-UHFFFAOYSA-N
Formula
C5H10O
SMILES
CCCCC=O
Molecular Weight1
86.13
CAS
110-62-3
Other Names
  • 1-Pentanal
  • 1-butanecarbaldehyde
  • Amyl aldehyde
  • Butyl formal
  • N-PENTANAL
  • NSC 35404
  • Pentan-1-al
  • Pentylaldehyde
  • UN 2058
  • VALERAL
  • VALERIC ACID ALDEHYDE
  • Valeraldehyde
  • Valerianic aldehyde
  • Valeric aldehyde
  • Valeryl aldehyde
  • butanecarbaldehyde
  • n-C4H9CHO
  • n-Valeraldehyde
  • n-Valeric aldehyde
  • pentanal (valeraldehyde)
  • valderaldehyde
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Physical Properties

Property Value Unit Source
ω 0.4000 KDB
PAff 796.60 kJ/mol NIST
BasG 764.80 kJ/mol NIST
μ 2.60 debye KDB
Δf -108.40 kJ/mol KDB
Δfgas -228.00 kJ/mol KDB
Δfus 10.99 kJ/mol Joback Calculated Property
Δvap [38.10; 38.60] kJ/mol Show Hide
Δvap 38.60 kJ/mol NIST
Δvap 38.30 kJ/mol NIST
Δvap 38.10 ± 0.10 kJ/mol NIST
IE [9.65; 9.90] eV Show Hide
IE 9.74 ± 0.04 eV NIST
IE 9.72 eV NIST
IE 9.89 ± 0.12 eV NIST
IE 9.90 eV NIST
IE 9.65 ± 0.02 eV NIST
IE 9.72 ± 0.06 eV NIST
IE 9.75 ± 0.01 eV NIST
IE 9.77 ± 0.01 eV NIST
IE 9.82 ± 0.05 eV NIST
IE 9.82 eV NIST
log10WS [-0.85; -0.85]   Show Hide
log10WS -0.85 Aq. Sol...
log10WS -0.85 Estimat...
logPoct/wat 1.375 Crippen Calculated Property
McVol 82.880 ml/mol McGowan Calculated Property
NFPA Fire 3 KDB
NFPA Health 1 KDB
Pc [3970.00; 3970.00] kPa Show Hide
Pc 3970.00 kPa KDB
Pc 3970.00 ± 100.00 kPa NIST
ρc 274.76 ± 5.17 kg/m3 NIST
Inp [650.00; 738.00]   Show Hide
Inp 677.34 NIST
Inp 673.91 NIST
Inp 674.37 NIST
Inp 675.18 NIST
Inp 676.24 NIST
Inp 677.00 NIST
Inp 674.00 NIST
Inp 675.00 NIST
Inp 676.00 NIST
Inp 664.10 NIST
Inp 673.50 NIST
Inp 679.00 NIST
Inp 688.00 NIST
Inp 666.00 NIST
Inp 672.00 NIST
Inp 661.00 NIST
Inp 670.00 NIST
Inp 663.00 NIST
Inp 677.00 NIST
Inp 676.00 NIST
Inp 679.00 NIST
Inp 680.00 NIST
Inp 681.00 NIST
Inp 678.00 NIST
Inp 684.00 NIST
Inp 686.00 NIST
Inp 675.00 NIST
Inp 678.00 NIST
Inp 696.00 NIST
Inp 699.00 NIST
Inp 695.00 NIST
Inp 700.00 NIST
Inp 691.00 NIST
Inp 698.00 NIST
Inp 722.00 NIST
Inp 722.00 NIST
Inp 705.00 NIST
Inp 697.00 NIST
Inp 697.00 NIST
Inp 690.90 NIST
Inp 698.00 NIST
Inp 707.00 NIST
Inp 708.00 NIST
Inp 704.00 NIST
Inp 702.00 NIST
Inp 658.00 NIST
Inp 690.00 NIST
Inp 705.00 NIST
Inp 678.00 NIST
Inp Outlier 657.00 NIST
Inp 709.00 NIST
Inp 680.00 NIST
Inp 709.00 NIST
Inp 698.00 NIST
Inp 674.00 NIST
Inp 674.00 NIST
Inp 678.10 NIST
Inp 696.00 NIST
Inp 679.00 NIST
Inp 700.00 NIST
Inp 700.00 NIST
Inp 687.00 NIST
Inp 719.00 NIST
Inp 692.00 NIST
Inp 692.00 NIST
Inp 675.00 NIST
Inp 675.00 NIST
Inp Outlier 732.00 NIST
Inp 702.00 NIST
Inp 687.00 NIST
Inp 694.00 NIST
Inp 674.00 NIST
Inp 715.00 NIST
Inp 696.00 NIST
Inp 703.00 NIST
Inp 699.00 NIST
Inp 711.00 NIST
Inp 704.00 NIST
Inp 704.00 NIST
Inp 710.00 NIST
Inp 668.00 NIST
Inp 690.00 NIST
Inp 711.00 NIST
Inp 674.00 NIST
Inp 672.00 NIST
Inp 683.00 NIST
Inp Outlier 650.00 NIST
Inp 702.00 NIST
Inp 703.00 NIST
Inp 701.00 NIST
Inp 705.00 NIST
Inp 697.00 NIST
Inp Outlier 738.00 NIST
Inp 670.00 NIST
Inp 701.00 NIST
Inp 706.00 NIST
Inp 670.00 NIST
Inp 705.00 NIST
Inp 696.00 NIST
Inp Outlier 732.00 NIST
Inp 708.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 689.00 NIST
Inp 680.00 NIST
Inp 705.00 NIST
Inp Outlier 732.00 NIST
Inp 697.00 NIST
Inp 696.00 NIST
Inp 699.00 NIST
Inp 708.00 NIST
Inp 669.00 NIST
Inp 715.00 NIST
Inp 705.00 NIST
Inp 698.00 NIST
Inp 666.00 NIST
Inp 669.00 NIST
Inp 672.00 NIST
Inp 697.00 NIST
Inp 700.00 NIST
Inp 698.00 NIST
Inp 697.00 NIST
Inp 666.99 NIST
Inp 693.00 NIST
Inp 689.00 NIST
Inp 668.00 NIST
Inp 695.00 NIST
Inp 699.00 NIST
Inp 674.00 NIST
Inp 668.00 NIST
Inp 703.00 NIST
Inp 696.00 NIST
Inp 700.00 NIST
Inp 700.00 NIST
Inp 676.00 NIST
Inp 705.00 NIST
Inp 697.00 NIST
Inp 700.00 NIST
Inp 670.00 NIST
Inp 694.00 NIST
Inp 668.00 NIST
Inp 693.00 NIST
Inp 694.00 NIST
Inp 694.00 NIST
Inp 673.00 NIST
Inp 671.00 NIST
Inp 677.00 NIST
Inp 677.00 NIST
Inp 667.00 NIST
Inp 669.00 NIST
Inp 669.00 NIST
Inp 684.00 NIST
Inp 702.00 NIST
Inp 704.00 NIST
Inp 706.00 NIST
Inp Outlier 732.00 NIST
Inp 690.00 NIST
Inp 706.00 NIST
Inp 698.00 NIST
Inp 717.00 NIST
Inp 668.00 NIST
Inp 701.00 NIST
Inp 704.00 NIST
Inp 665.00 NIST
Inp 704.00 NIST
Inp 715.00 NIST
Inp 673.00 NIST
Inp 698.00 NIST
Inp 715.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 696.00 NIST
Inp 697.00 NIST
Inp 697.00 NIST
Inp 698.00 NIST
Inp 700.00 NIST
Inp 700.00 NIST
Inp 700.00 NIST
Inp 705.00 NIST
Inp 676.00 NIST
Inp 661.00 NIST
Inp Outlier 732.00 NIST
Inp 686.00 NIST
Inp 698.00 NIST
Inp 698.00 NIST
Inp 674.00 NIST
Inp Outlier 727.00 NIST
Inp 669.00 NIST
Inp 694.00 NIST
Inp 674.00 NIST
Inp 700.00 NIST
Inp 699.00 NIST
Inp 695.00 NIST
Inp 707.00 NIST
Inp 709.00 NIST
Inp 680.00 NIST
Inp 678.00 NIST
Inp 722.00 NIST
Inp 683.00 NIST
Inp 677.00 NIST
Inp 700.00 NIST
Inp 680.00 NIST
Inp 671.00 NIST
Inp 671.00 NIST
Inp 677.00 NIST
Inp 700.00 NIST
Inp 668.00 NIST
Inp 694.00 NIST
Inp 675.00 NIST
Inp 677.00 NIST
Inp 694.00 NIST
Inp 685.00 NIST
Inp 679.00 NIST
Inp 696.00 NIST
Inp 698.00 NIST
Inp 697.00 NIST
Inp 704.00 NIST
Inp 678.00 NIST
Inp 679.00 NIST
Inp 692.00 NIST
Inp Outlier 732.00 NIST
Inp 715.00 NIST
Inp 711.00 NIST
I [929.00; 1013.00]   Show Hide
I 1013.00 NIST
I 998.10 NIST
I 1002.80 NIST
I 1007.40 NIST
I 979.00 NIST
I 979.00 NIST
I 974.00 NIST
I 950.00 NIST
I 951.00 NIST
I 978.00 NIST
I 974.00 NIST
I 981.00 NIST
I 984.00 NIST
I 984.00 NIST
I 984.00 NIST
I 976.00 NIST
I 984.00 NIST
I 955.00 NIST
I 950.00 NIST
I 980.00 NIST
I 1003.00 NIST
I 999.00 NIST
I 982.00 NIST
I 971.00 NIST
I 987.00 NIST
I 984.00 NIST
I 968.00 NIST
I 968.00 NIST
I 968.00 NIST
I 978.00 NIST
I 986.00 NIST
I 1004.00 NIST
I 982.00 NIST
I 982.00 NIST
I 982.00 NIST
I 983.00 NIST
I 977.00 NIST
I 985.00 NIST
I 983.00 NIST
I 984.00 NIST
I 982.00 NIST
I 992.00 NIST
I 972.00 NIST
I 964.00 NIST
I 985.00 NIST
I 991.00 NIST
I 971.00 NIST
I 973.00 NIST
I 1004.00 NIST
I 1005.00 NIST
I 1006.00 NIST
I 989.00 NIST
I 980.00 NIST
I 977.00 NIST
I Outlier 934.00 NIST
I 953.00 NIST
I 986.00 NIST
I 979.00 NIST
I Outlier 935.00 NIST
I Outlier 929.00 NIST
I 941.00 NIST
I 984.00 NIST
I 1004.00 NIST
I 1011.00 NIST
I Outlier 935.00 NIST
I 991.00 NIST
I Outlier 934.00 NIST
I 981.00 NIST
I 977.00 NIST
I 979.00 NIST
I 970.00 NIST
I 953.00 NIST
I 981.00 NIST
I 974.00 NIST
I 993.00 NIST
I 971.00 NIST
I 982.00 NIST
I 983.00 NIST
I 973.00 NIST
I 967.00 NIST
I 967.00 NIST
I 960.00 NIST
I 963.00 NIST
I 1003.00 NIST
I 960.00 NIST
I 960.00 NIST
I 1002.00 NIST
I 975.00 NIST
I 973.00 NIST
I 979.00 NIST
I 975.00 NIST
I 975.00 NIST
I 976.00 NIST
I 951.00 NIST
I 954.00 NIST
I 970.00 NIST
I 982.00 NIST
I 1005.00 NIST
I 988.00 NIST
I Outlier 937.00 NIST
I 976.00 NIST
I 983.00 NIST
I 977.00 NIST
I 985.00 NIST
I 972.00 NIST
I 943.00 NIST
I 983.00 NIST
I 973.00 NIST
I Outlier 932.00 NIST
I 944.00 NIST
I 993.00 NIST
I 998.00 NIST
I 967.00 NIST
I 1002.00 NIST
I Outlier 935.00 NIST
I 988.00 NIST
I 975.00 NIST
I 948.00 NIST
I 963.00 NIST
I 967.00 NIST
I 976.00 NIST
I 973.00 NIST
I 1002.00 NIST
I 983.00 NIST
I 982.00 NIST
gas 379.90 ± 3.30 J/mol×K NIST
liquid [273.59; 273.60] J/mol×K Show Hide
liquid 273.59 J/mol×K NIST
liquid 273.60 J/mol×K NIST
Tboil [373.65; 376.90] K Show Hide
Tboil 376.00 K KDB
Tboil 376.20 K Isobari...
Tboil 376.20 K NIST
Tboil 375.83 ± 0.02 K NIST
Tboil 376.15 K NIST
Tboil 376.15 ± 2.00 K NIST
Tboil 375.65 ± 2.00 K NIST
Tboil 375.15 ± 2.00 K NIST
Tboil 376.00 ± 4.00 K NIST
Tboil 376.65 ± 1.50 K NIST
Tboil 375.65 ± 2.00 K NIST
Tboil 375.35 ± 1.50 K NIST
Tboil 374.15 ± 3.00 K NIST
Tboil 375.65 ± 3.00 K NIST
Tboil 375.25 ± 2.00 K NIST
Tboil Outlier 373.65 ± 3.00 K NIST
Tboil 375.90 ± 2.00 K NIST
Tboil 376.90 ± 1.00 K NIST
Tboil 376.15 ± 2.00 K NIST
Tboil 374.65 ± 3.00 K NIST
Tboil 376.55 ± 3.00 K NIST
Tboil 375.15 ± 3.00 K NIST
Tc [566.10; 568.30] K Show Hide
Tc 566.10 K KDB
Tc 568.30 ± 2.00 K NIST
Tc 566.10 ± 0.80 K NIST
Tfus [181.60; 191.59] K Show Hide
Tfus 181.60 K KDB
Tfus 181.65 K Aq. Sol...
Tfus 191.59 K NIST
Tfus 191.59 ± 0.10 K NIST
Tfus 182.15 K NIST
Tfus 189.80 ± 1.00 K NIST
Tfus 189.80 ± 0.60 K NIST
Tfus 181.70 ± 3.00 K NIST
Vc 0.313 m3/kmol KDB
Zc 0.2640010 KDB

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [144.57; 190.38] J/mol×K [362.46; 535.33] Show Hide
Cp,gas 144.57 J/mol×K 362.46 Joback Calculated Property
Cp,gas 152.96 J/mol×K 391.27 Joback Calculated Property
Cp,gas 161.04 J/mol×K 420.08 Joback Calculated Property
Cp,gas 168.81 J/mol×K 448.89 Joback Calculated Property
Cp,gas 176.29 J/mol×K 477.71 Joback Calculated Property
Cp,gas 183.48 J/mol×K 506.52 Joback Calculated Property
Cp,gas 190.38 J/mol×K 535.33 Joback Calculated Property
Cp,liquid [171.50; 174.39] J/mol×K [298.00; 298.15] Show Hide
Cp,liquid 171.50 J/mol×K 298.00 NIST
Cp,liquid 174.39 J/mol×K 298.15 NIST
η [0.0003071; 0.0037054] Pa×s [188.11; 362.46] Show Hide
η 0.0037054 Pa×s 188.11 Joback Calculated Property
η 0.0018535 Pa×s 217.17 Joback Calculated Property
η 0.0010918 Pa×s 246.23 Joback Calculated Property
η 0.0007192 Pa×s 275.28 Joback Calculated Property
η 0.0005130 Pa×s 304.34 Joback Calculated Property
η 0.0003882 Pa×s 333.40 Joback Calculated Property
η 0.0003071 Pa×s 362.46 Joback Calculated Property
ΔfusH 15.00 kJ/mol 151.60 NIST
ΔvapH [33.64; 37.30] kJ/mol [341.00; 376.00] Show Hide
ΔvapH 37.30 kJ/mol 341.00 NIST
ΔvapH 33.64 kJ/mol 376.00 KDB
Pvap 101.30 kPa 376.20 Isobari...
ρl 810.00 kg/m3 293.00 KDB
γ 0.03 N/m 293.20 KDB

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [277.13; 400.24] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.47593e+01
Coefficient B-3.35057e+03
Coefficient C-4.56010e+01
Temperature range, min.277.13
Temperature range, max.400.24
Pvap 1.33 kPa 277.13 Calculated Property
Pvap 2.99 kPa 290.81 Calculated Property
Pvap 6.15 kPa 304.49 Calculated Property
Pvap 11.78 kPa 318.17 Calculated Property
Pvap 21.20 kPa 331.85 Calculated Property
Pvap 36.16 kPa 345.52 Calculated Property
Pvap 58.86 kPa 359.20 Calculated Property
Pvap 92.00 kPa 372.88 Calculated Property
Pvap 138.72 kPa 386.56 Calculated Property
Pvap 202.65 kPa 400.24 Calculated Property
Pvap [5.58e-05; 3498.61] kPa [182.00; 554.00] KDB Vap... Show Hide
Equationln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A1.03053e+02
Coefficient B-8.05774e+03
Coefficient C-1.32459e+01
Coefficient D1.08452e-05
Temperature range, min.182.00
Temperature range, max.554.00
Pvap 5.58e-05 kPa 182.00 Calculated Property
Pvap 0.02 kPa 223.33 Calculated Property
Pvap 0.59 kPa 264.67 Calculated Property
Pvap 6.83 kPa 306.00 Calculated Property
Pvap 39.25 kPa 347.33 Calculated Property
Pvap 145.13 kPa 388.67 Calculated Property
Pvap 402.94 kPa 430.00 Calculated Property
Pvap 925.58 kPa 471.33 Calculated Property
Pvap 1875.04 kPa 512.67 Calculated Property
Pvap 3498.61 kPa 554.00 Calculated Property

Similar Compounds

Hexanal. Heptanal. Triacontanal. Nonanal. Decanal. Dodecanal. Tridecanal. Tetradecanal. Pentacosanal. Undecanal. Octadecanal. Docosanal. octacosanal. Heptacosanal. Pentadecanal-.

Find more compounds similar to Pentanal.

Mixtures

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.