Chemical Properties of Pentanoic acid, 4-oxo- (CAS 123-76-2)

Pentanoic acid, 4-oxo-

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InChI
InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
InChI Key
JOOXCMJARBKPKM-UHFFFAOYSA-N
Formula
C5H8O3
SMILES
CC(=O)CCC(=O)O
Molecular Weight1
116.12
CAS
123-76-2
Other Names
  • .beta.-acetylpropionic acid
  • 3-Acetylpropionic acid
  • 4-Ketovaleric acid
  • 4-Oxo-pentanoic acid (levulinic acid)
  • 4-Oxopentanoic acid
  • 4-Oxovaleric acid
  • Acetopropionic acid
  • Acetylpropionic acid
  • LEVA
  • Laevulic acid
  • Laevulinic acid
  • Levulic acid
  • Levulinic acid
  • NSC 3716
  • Propionic acid, 3-acetyl-
  • USAF CZ-1
  • Valeric acid, 4-oxo-
  • Valeric acid, 4-oxo-(levulinic acid)
  • «beta»-Acetylpropionic acid
  • «gamma»-Ketovaleric acid
  • «beta»-Acetylpropionic acid
  • «gamma»-Ketovaleric acid

Physical Properties

Property Value Unit Source
Δf -403.44 kJ/mol Joback Calculated Property
Δfgas -523.92 kJ/mol Joback Calculated Property
Δfus 15.99 kJ/mol Joback Calculated Property
Δvap 56.89 kJ/mol Joback Calculated Property
log10WS -0.29 Crippen Calculated Property
logPoct/wat 0.440 Crippen Calculated Property
McVol 90.320 ml/mol McGowan Calculated Property
Pc 4565.38 kPa Joback Calculated Property
Inp [1063.20; 1063.20]   Show Hide
Inp 1063.20 NIST
Inp 1063.20 NIST
I [2312.00; 2340.00]   Show Hide
I 2317.00 NIST
I 2312.00 NIST
I 2340.00 NIST
I 2317.00 NIST
Tboil [518.20; 518.70] K Show Hide
Tboil 518.20 ± 0.10 K Phase e...
Tboil 518.20 K Phase e...
Tboil 518.70 K NIST
Tc 695.98 K Joback Calculated Property
Tfus [306.00; 310.00] K Show Hide
Tfus 306.00 ± 2.00 K NIST
Tfus 310.00 ± 1.00 K NIST
Vc 0.346 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [194.80; 232.95] J/mol×K [513.72; 695.98] Show Hide
Cp,gas 194.80 J/mol×K 513.72 Joback Calculated Property
Cp,gas 201.95 J/mol×K 544.10 Joback Calculated Property
Cp,gas 208.77 J/mol×K 574.47 Joback Calculated Property
Cp,gas 215.27 J/mol×K 604.85 Joback Calculated Property
Cp,gas 221.47 J/mol×K 635.23 Joback Calculated Property
Cp,gas 227.36 J/mol×K 665.60 Joback Calculated Property
Cp,gas 232.95 J/mol×K 695.98 Joback Calculated Property
η [0.0002045; 0.0104113] Pa×s [306.79; 513.72] Show Hide
η 0.0104113 Pa×s 306.79 Joback Calculated Property
η 0.0038842 Pa×s 341.28 Joback Calculated Property
η 0.0017366 Pa×s 375.77 Joback Calculated Property
η 0.0008890 Pa×s 410.25 Joback Calculated Property
η 0.0005049 Pa×s 444.74 Joback Calculated Property
η 0.0003110 Pa×s 479.23 Joback Calculated Property
η 0.0002045 Pa×s 513.72 Joback Calculated Property
ΔfusH [9.22; 9.22] kJ/mol [306.20; 306.20] Show Hide
ΔfusH 9.22 kJ/mol 306.20 NIST
ΔfusH 9.22 kJ/mol 306.20 NIST
ΔvapH [70.32; 74.40] kJ/mol [298.15; 447.00] Show Hide
ΔvapH 70.32 kJ/mol 298.15 Renewab...
ΔvapH 74.40 kJ/mol 447.00 NIST
Pvap [7.05e-03; 0.13] kPa [328.40; 373.40] Show Hide
Pvap 7.05e-03 kPa 328.40 Renewab...
Pvap 0.01 kPa 333.40 Renewab...
Pvap 0.01 kPa 338.30 Renewab...
Pvap 0.02 kPa 343.30 Renewab...
Pvap 0.02 kPa 343.40 Renewab...
Pvap 0.03 kPa 348.30 Renewab...
Pvap 0.04 kPa 353.30 Renewab...
Pvap 0.05 kPa 358.30 Renewab...
Pvap 0.05 kPa 358.40 Renewab...
Pvap 0.08 kPa 363.40 Renewab...
Pvap 0.10 kPa 368.40 Renewab...
Pvap 0.13 kPa 373.40 Renewab...
n0 [1.43950; 1.43950]   [293.15; 293.15] Show Hide
n0 1.43950 ± 0.00005 293.15 Phase e...
n0 1.43950 293.15 Phase e...
ρl [1133.50; 1135.71] kg/m3 [293.15; 298.15] Show Hide
ρl 1133.50 ± 0.01 kg/m3 293.15 Phase e...
ρl 1133.50 kg/m3 293.15 Phase e...
ρl 1135.71 kg/m3 298.15 Extract...

Similar Compounds

4-Ketopimelic. 4,6-Dioxoheptanoic acid. Heptanoic acid, 6-oxo-. 4-Acetylbutyric acid. Pentanoic acid, 4-oxo-, methyl ester. Pentanoic acid. 2-Oxopentanedioic acid. Hexanedioic acid. Hexanoic acid. 2-Pentanone, 5-hydroxy-. n-Decanoic acid. Octacosanoic acid. Tetradecanoic acid. Tridecanoic acid. Nonanoic acid.

Find more compounds similar to Pentanoic acid, 4-oxo-.

Mixtures

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