Chemical Properties of 2-Cyclohexen-1-one, 2-hydroxy-6-methyl-3-(1-methylethyl)- (CAS 54783-36-7)

2-Cyclohexen-1-one, 2-hydroxy-6-methyl-3-(1-methylethyl)-

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InChI
InChI=1S/C10H16O2/c1-6(2)8-5-4-7(3)9(11)10(8)12/h6-7,12H,4-5H2,1-3H3
InChI Key
POVACFJTDXZOQT-UHFFFAOYSA-N
Formula
C10H16O2
SMILES
CC(C)C1=C(O)C(=O)C(C)CC1
Molecular Weight1
168.23
CAS
54783-36-7
Other Names
  • 2-Hydroxy-3-isopropyl-6-methylcyclohex-2-enone
  • 2-hydroxy-3-(isopropyl)-6-methylcyclohex-2-en-1-one
Sources

Physical Properties

Property Value Unit Source
Δf -193.38 kJ/mol Joback Calculated Property
Δfgas -455.78 kJ/mol Joback Calculated Property
Δfus 14.01 kJ/mol Joback Calculated Property
Δvap 60.44 kJ/mol Joback Calculated Property
logPoct/wat 2.45 Crippen Calculated Property
Pc 2979.54 kPa Joback Calculated Property
Tboil 616.43 K Joback Calculated Property
Tc 823.06 K Joback Calculated Property
Tfus 349.68 K Joback Calculated Property
Vc 0.53 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 380.65 J/mol×K 616.43 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
>C=O (ring) 1
-OH (alcohol) 1
=C< (ring) 2
-CH3 3
>CH- (ring) 1
-CH2- (ring) 2

Similar Compounds

2-Cyclohexen-1-one, 2-hydroxy-3-methyl-6-(1-methylethyl)-. 2-Cyclopenten-1-one, 2-hydroxy-3-ethyl-5-methyl. 2-Hydroxy-3-isopropyl-2-cyclopenten-1-one. 2-Cyclohexen-1-one, 6-methyl-3-(1-methylethyl)-. 2-Hydroxy-3-methyl-2-cyclohexen-1-one. 5-Ethyl-2-hydroxy-3-methyl-2-cyclopenten-1-one. 2-Hydroxy-3,5,5-trimethyl-cyclohex-2-enone. 2-Cyclopenten-1-one, 2-hydroxy-3,4,5-trimethyl, trans. 2-Cyclopenten-1-one, 2-hydroxy-3,4,5-trimethyl, cis. 3-Ethyl-2-hydroxy-4-methyl-2-cyclopenten-1-one. 3-Butyl-2-hydroxy-2-cyclopenten-1-one. 2-Cyclohexene-1,4-dione, 2-hydroxy-3,5,5-trimethyl-. 17-epi-Oxamesterone. 4-Androsten-3-one, 4,17beta-dihydroxy-17alpha-methyl-. Oxymesterone.

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