Chemical Properties of 2-HYDROXY-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE

2-HYDROXY-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE

InChI
InChI=1S/C9H14O2/c1-6-4-9(2,3)5-7(10)8(6)11/h11H,4-5H2,1-3H3
InChI Key
DWGZTTFGUFHAJX-UHFFFAOYSA-N
Formula
C9H14O2
SMILES
CC1=C(O)C(=O)CC(C)(C)C1
Molecular Weight1
154.21
Other Names
  • 2-Hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one
  • 2-Hydroxyisophorone
  • 2-Cyclohexen-1-one, 2-hydroxy-3,5,5-trimethyl-
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Physical Properties

Property Value Unit Source
ΔfusH° 8.64 kJ/mol Joback Calculated Property
IE 8.82 eV Relay (1.0) Calculated Property
logPoct/wat 2.208 Crippen Calculated Property
McVol 129.950 ml/mol McGowan Calculated Property
Inp [1149.80; 1194.00]   Show Hide
Inp 1149.80 NIST
Inp 1194.00 NIST
Ip [1648.00; 1675.00]   Show Hide
Ip 1675.00 NIST
Ip 1648.00 NIST
Ip 1675.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [171.86; 456.47] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-4.27900e+01
Coefficient B9.63560e-01
Coefficient C-7.19000e-04
Coefficient D2.54700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 171.86 J/mol×K 273.00 Calculated Property
Cp,gas 219.38 J/mol×K 353.78 Calculated Property
Cp,gas 261.06 J/mol×K 434.56 Calculated Property
Cp,gas 297.68 J/mol×K 515.33 Calculated Property
Cp,gas 330.06 J/mol×K 596.11 Calculated Property
Cp,gas 358.99 J/mol×K 676.89 Calculated Property
Cp,gas 385.30 J/mol×K 757.67 Calculated Property
Cp,gas 409.78 J/mol×K 838.44 Calculated Property
Cp,gas 433.23 J/mol×K 919.22 Calculated Property
Cp,gas 456.47 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-Cyclohexene-1,4-dione, 2-hydroxy-3,5,5-trimethyl-. 2-hydroxy-3,5,5-trimethyl-4-methylenecyclohex-2-en-1-one. 2-Hydroxy-3-methyl-2-cyclohexen-1-one. 4-Ethyl-3-methyl-2-hydroxycyclopent-2-en-1-one. 2-Cyclopenten-1-one, 2-hydroxy-3,5,5-trimethyl. 2-Cyclohexen-1-one, 2-hydroxy-3-methyl-6-(1-methylethyl)-. 2-Cyclopenten-1-one, 2-hydroxy-3,4,4-trimethyl. 2-methoxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione. 2-Cyclohexen-1-one, 2-hydroxy-6-methyl-3-(1-methylethyl)-. 5-Ethyl-2-hydroxy-3-methyl-2-cyclopenten-1-one. Cyclohexanepropionic acid, 4,4-dimethyl-2,6-dioxo-. 2-Cyclopenten-1-one, 2-hydroxy-3-ethyl-4-methyl. 2-Cyclopenten-1-one, 2-hydroxy-3,4-dimethyl-. Isophorone. 3-BUTYL-2-HYDROXY-2-CYCLOPENTEN-1-ONE.

Find more compounds similar to 2-HYDROXY-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE.

Sources

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