Chemical Properties of 3-Hexanone, 5-methyl- (CAS 623-56-3)

3-Hexanone, 5-methyl-

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InChI
InChI=1S/C7H14O/c1-4-7(8)5-6(2)3/h6H,4-5H2,1-3H3
InChI Key
DXVYLFHTJZWTRF-UHFFFAOYSA-N
Formula
C7H14O
SMILES
CCC(=O)CC(C)C
Molecular Weight1
114.19
CAS
623-56-3
Other Names
  • Ethyl isobutyl ketone
  • Isobutyl ethyl ketone
  • 2-Methyl-4-hexanone
  • 5-Methyl-3-hexanone
  • 5-methylhexan-3-one

Physical Properties

Property Value Unit Source
Δf -123.30 kJ/mol Joback Calculated Property
Δfgas -305.67 kJ/mol Joback Calculated Property
Δfus 11.96 kJ/mol Joback Calculated Property
Δvap 37.53 kJ/mol Joback Calculated Property
log10WS -1.79 Crippen Calculated Property
logPoct/wat 2.012 Crippen Calculated Property
McVol 111.060 ml/mol McGowan Calculated Property
Pc 3022.28 kPa Joback Calculated Property
Inp [816.00; 865.00]   Show Hide
Inp 816.70 NIST
Inp Outlier 865.00 NIST
Inp 816.00 NIST
Inp 817.00 NIST
Inp 816.00 NIST
Inp 817.00 NIST
Inp 816.00 NIST
Inp 816.70 NIST
I 1005.00 NIST
Tboil [408.15; 412.15] K Show Hide
Tboil 409.15 ± 2.00 K NIST
Tboil 408.15 ± 2.00 K NIST
Tboil 409.00 ± 3.00 K NIST
Tboil Outlier 412.15 ± 1.00 K NIST
Tboil 409.65 ± 2.00 K NIST
Tboil 409.00 ± 1.00 K NIST
Tc 593.63 K Joback Calculated Property
Tfus 203.58 K Joback Calculated Property
Vc 0.427 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [215.47; 278.88] J/mol×K [412.99; 593.63] Show Hide
Cp,gas 215.47 J/mol×K 412.99 Joback Calculated Property
Cp,gas 227.17 J/mol×K 443.10 Joback Calculated Property
Cp,gas 238.41 J/mol×K 473.20 Joback Calculated Property
Cp,gas 249.19 J/mol×K 503.31 Joback Calculated Property
Cp,gas 259.52 J/mol×K 533.42 Joback Calculated Property
Cp,gas 269.42 J/mol×K 563.52 Joback Calculated Property
Cp,gas 278.88 J/mol×K 593.63 Joback Calculated Property
η [0.0002897; 0.0065747] Pa×s [203.58; 412.99] Show Hide
η 0.0065747 Pa×s 203.58 Joback Calculated Property
η 0.0026700 Pa×s 238.48 Joback Calculated Property
η 0.0013648 Pa×s 273.38 Joback Calculated Property
η 0.0008121 Pa×s 308.28 Joback Calculated Property
η 0.0005371 Pa×s 343.19 Joback Calculated Property
η 0.0003833 Pa×s 378.09 Joback Calculated Property
η 0.0002897 Pa×s 412.99 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 407.20 K 98.00 NIST

Similar Compounds

4-Heptanone, 2-methyl-. 4-Heptanone, 2,6-dimethyl-. 4-Octanone, 2-methyl-. 2-Methyltetradecan-4-one. 2-Methyltridecan-4-one. 2-Methyl-4-decanone. Neopentyl isobutyl ketone. 3-Hexanone, 2,5-dimethyl-. 2,12-Dimethyltridecan-4-one. 2,7-Dimethyloctan-4-one. 3-Heptanone, 5-methyl-. 2,4-Heptanedione, 6-methyl-. 9-methyldecan-3-one. 7-methyloctan-3-one. 4-Nonanone, 8-methyl-.

Find more compounds similar to 3-Hexanone, 5-methyl-.

Sources

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