Chemical Properties of 3-Hexanone, 2,5-dimethyl- (CAS 1888-57-9)

3-Hexanone, 2,5-dimethyl-

PDF Excel Molecule Calculator
InChI
InChI=1S/C8H16O/c1-6(2)5-8(9)7(3)4/h6-7H,5H2,1-4H3
InChI Key
TUIWMHDSXJWXOH-UHFFFAOYSA-N
Formula
C8H16O
SMILES
CC(C)CC(=O)C(C)C
Molecular Weight1
128.21
CAS
1888-57-9
Other Names
  • 2,5-Dimethyl-3-hexanone
  • Isobutyl isopropyl ketone
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -117.32 kJ/mol Joback Calculated Property
Δfgas -331.59 kJ/mol Joback Calculated Property
Δfus 11.03 kJ/mol Joback Calculated Property
Δvap 39.37 kJ/mol Joback Calculated Property
log10WS -1.97 Crippen Calculated Property
logPoct/wat 2.258 Crippen Calculated Property
McVol 125.150 ml/mol McGowan Calculated Property
Pc 2749.78 kPa Joback Calculated Property
I [1145.00; 1145.00]   Show Hide
I 1145.00 NIST
I 1145.00 NIST
I 1145.00 NIST
Tboil [416.00; 466.00] K Show Hide
Tboil 420.70 K NIST
Tboil 416.00 ± 4.00 K NIST
Tboil 466.00 ± 30.00 K NIST
Tboil 421.00 ± 3.00 K NIST
Tc 618.82 K Joback Calculated Property
Tfus 199.85 K Joback Calculated Property
Vc 0.477 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [255.61; 326.99] J/mol×K [435.43; 618.82] Show Hide
Cp,gas 255.61 J/mol×K 435.43 Joback Calculated Property
Cp,gas 268.85 J/mol×K 466.00 Joback Calculated Property
Cp,gas 281.53 J/mol×K 496.56 Joback Calculated Property
Cp,gas 293.67 J/mol×K 527.13 Joback Calculated Property
Cp,gas 305.29 J/mol×K 557.69 Joback Calculated Property
Cp,gas 316.39 J/mol×K 588.26 Joback Calculated Property
Cp,gas 326.99 J/mol×K 618.82 Joback Calculated Property
η [0.0002700; 0.0114893] Pa×s [199.85; 435.43] Show Hide
η 0.0114893 Pa×s 199.85 Joback Calculated Property
η 0.0036803 Pa×s 239.11 Joback Calculated Property
η 0.0016253 Pa×s 278.38 Joback Calculated Property
η 0.0008785 Pa×s 317.64 Joback Calculated Property
η 0.0005437 Pa×s 356.90 Joback Calculated Property
η 0.0003700 Pa×s 396.17 Joback Calculated Property
η 0.0002700 Pa×s 435.43 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [314.02; 446.62] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.50079e+01
Coefficient B-3.76736e+03
Coefficient C-5.80910e+01
Temperature range, min.314.02
Temperature range, max.446.62
Pvap 1.33 kPa 314.02 Calculated Property
Pvap 2.97 kPa 328.75 Calculated Property
Pvap 6.09 kPa 343.49 Calculated Property
Pvap 11.65 kPa 358.22 Calculated Property
Pvap 20.96 kPa 372.95 Calculated Property
Pvap 35.79 kPa 387.69 Calculated Property
Pvap 58.37 kPa 402.42 Calculated Property
Pvap 91.44 kPa 417.15 Calculated Property
Pvap 138.28 kPa 431.89 Calculated Property
Pvap 202.65 kPa 446.62 Calculated Property

Similar Compounds

3-Hexanone, 2-methyl-. 3,5-Octanedione, 2,7-dimethyl-. 3-Hexanone, 5-methyl-. t-Butyl isobutyl ketone. 3-Heptanone, 2,6-dimethyl-. 4-Heptanone, 2,6-dimethyl-. 4-Heptanone, 3-methyl-. 3-Heptanone, 2-methyl-. 4-Heptanone, 2-methyl-. 2,12-Dimethyltridecan-4-one. 2,5-Dimethylcyclohexanone. 3,8-Decanedione, 2,9-dimethyl-. 2,7-Dimethyloctan-4-one. 3-Nonanone, 2-methyl-. 3-Octanone, 2-methyl-.

Find more compounds similar to 3-Hexanone, 2,5-dimethyl-.

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.