Chemical Properties of 3-Hexanone, 4,4-dimethyl- (CAS 19550-14-2)

3-Hexanone, 4,4-dimethyl-

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InChI
InChI=1S/C8H16O/c1-5-7(9)8(3,4)6-2/h5-6H2,1-4H3
InChI Key
YEDJXYBDQSVPFJ-UHFFFAOYSA-N
Formula
C8H16O
SMILES
CCC(=O)C(C)(C)CC
Molecular Weight1
128.21
CAS
19550-14-2
Other Names
  • 4,4-Dimethyl-3-hexanone
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Physical Properties

Property Value Unit Source
Δf -109.60 kJ/mol Joback Calculated Property
Δfgas -329.78 kJ/mol Joback Calculated Property
Δfus 10.66 kJ/mol Joback Calculated Property
Δvap 38.85 kJ/mol Joback Calculated Property
log10WS -2.21 Crippen Calculated Property
logPoct/wat 2.402 Crippen Calculated Property
McVol 125.150 ml/mol McGowan Calculated Property
Pc 2758.46 kPa Joback Calculated Property
Tboil [424.00; 426.65] K Show Hide
Tboil 424.20 K NIST
Tboil 426.65 ± 1.50 K NIST
Tboil 424.00 ± 3.00 K NIST
Tboil 424.20 ± 3.00 K NIST
Tc 619.80 K Joback Calculated Property
Tfus 232.27 K Joback Calculated Property
Vc 0.478 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [257.73; 330.68] J/mol×K [433.08; 619.80] Show Hide
Cp,gas 257.73 J/mol×K 433.08 Joback Calculated Property
Cp,gas 271.54 J/mol×K 464.20 Joback Calculated Property
Cp,gas 284.66 J/mol×K 495.32 Joback Calculated Property
Cp,gas 297.11 J/mol×K 526.44 Joback Calculated Property
Cp,gas 308.91 J/mol×K 557.56 Joback Calculated Property
Cp,gas 320.09 J/mol×K 588.68 Joback Calculated Property
Cp,gas 330.68 J/mol×K 619.80 Joback Calculated Property
η [0.0003081; 0.0068051] Pa×s [232.27; 433.08] Show Hide
η 0.0068051 Pa×s 232.27 Joback Calculated Property
η 0.0029357 Pa×s 265.74 Joback Calculated Property
η 0.0015286 Pa×s 299.21 Joback Calculated Property
η 0.0009076 Pa×s 332.67 Joback Calculated Property
η 0.0005927 Pa×s 366.14 Joback Calculated Property
η 0.0004158 Pa×s 399.61 Joback Calculated Property
η 0.0003081 Pa×s 433.08 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.66] kPa [314.42; 451.15] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.47248e+01
Coefficient B-3.69868e+03
Coefficient C-5.82300e+01
Temperature range, min.314.42
Temperature range, max.451.15
Pvap 1.33 kPa 314.42 Calculated Property
Pvap 2.99 kPa 329.61 Calculated Property
Pvap 6.16 kPa 344.80 Calculated Property
Pvap 11.80 kPa 360.00 Calculated Property
Pvap 21.23 kPa 375.19 Calculated Property
Pvap 36.21 kPa 390.38 Calculated Property
Pvap 58.93 kPa 405.57 Calculated Property
Pvap 92.07 kPa 420.77 Calculated Property
Pvap 138.78 kPa 435.96 Calculated Property
Pvap 202.66 kPa 451.15 Calculated Property

Similar Compounds

C2H5C(CH3)2COCH3. 5,5-Dimethyl-2,4-heptanedione. 2-Hexanone, 3,3-dimethyl-. 2-Pentanone, 3-ethyl-3-methyl-. Cyclohexanone, 2,2-dimethyl-. Cyclopentanone, 2,2-dimethyl-. 3,3-Dimethyl-2,7-octanedione. 1,3-Cyclohexanedione, 4,4-dimethyl-. Cyclopentanone, 2,2,5,5-tetramethyl-. Ethanone, 1-(1-methylcyclohexyl)-. 3-Hexanone, 4-methyl-. 2,2-Dimethyl-3-heptanone. 3-Hexanone, 2,2-dimethyl-. 2,2,6,6,-Tetramethylcyclohexanone. 2,2-Dimethyl-3-octanone.

Find more compounds similar to 3-Hexanone, 4,4-dimethyl-.

Sources

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