Chemical Properties of 2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-

2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-

InChI
InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3
InChI Key
QJJDNZGPQDGNDX-UHFFFAOYSA-N
Formula
C13H22O
SMILES
CC(=O)CCC1=C(C)CCCC1(C)C
Molecular Weight1
194.32
Other Names
  • «alpha»,«beta»-Dihydro-«beta»-ionone
  • «beta»-Ionone, dihydro-
  • Dihydro-«beta»-ionone
  • 4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-2-butanone
  • 4-(2,6,6-Trimethyl-1-cyclohexenyl)-2-butanone
  • 7,8-Dihydro-«beta»-ionone
  • 1-(1,1,5-Trimethylcyclohex-5-en-6-yl)-butan-3-one
  • «beta»-7,8-Dihydroionone
  • 7,8-dehydro-«beta»-ionone
  • 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)butan-2-one
  • 4-(1,1,5-Trimethylcyclohex-5-en-6-yl)-butan-3-one
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Physical Properties

Property Value Unit Source
ΔfusH° 17.01 kJ/mol Joback Calculated Property
logPoct/wat 3.882 Crippen Calculated Property
McVol 180.440 ml/mol McGowan Calculated Property
Inp [1405.00; 1444.00]   Show Hide
Inp 1427.80 NIST
Inp 1414.00 NIST
Inp 1414.00 NIST
Inp 1413.00 NIST
Inp 1414.00 NIST
Inp 1436.00 NIST
Inp 1433.00 NIST
Inp 1438.60 NIST
Inp 1419.00 NIST
Inp 1433.00 NIST
Inp 1440.00 NIST
Inp 1443.90 NIST
Inp 1433.00 NIST
Inp 1431.00 NIST
Inp 1444.00 NIST
Inp 1433.00 NIST
Inp 1432.00 NIST
Inp 1405.00 NIST
Inp 1436.00 NIST
Inp 1414.00 NIST
I [1825.00; 1854.00]   Show Hide
I 1854.00 NIST
I 1825.00 NIST
I 1838.00 NIST
I 1842.00 NIST
I 1849.00 NIST
I 1849.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [456.66; 553.72] J/mol×K [579.62; 789.51] Show Hide
Cp,gas 456.66 J/mol×K 579.62 Joback Calculated Property
Cp,gas 474.94 J/mol×K 614.60 Joback Calculated Property
Cp,gas 492.25 J/mol×K 649.58 Joback Calculated Property
Cp,gas 508.68 J/mol×K 684.57 Joback Calculated Property
Cp,gas 524.34 J/mol×K 719.55 Joback Calculated Property
Cp,gas 539.31 J/mol×K 754.53 Joback Calculated Property
Cp,gas 553.72 J/mol×K 789.51 Joback Calculated Property

Similar Compounds

5-Octen-2-one, 6-methyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)-. Spiro[8,8-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2,2'-cyclohexanone-1]. Spiro[8,8-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-3,2'-cyclohexanone-1']. 1-Cyclohexene-1-acetaldehyde, 2,6,6-trimethyl-. Spiro[8,8-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-3,2'-cyclopentanone-1']. Spiro[8,8-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2,2'-cyclopentanone-1']. 2,4,4-Trimethyl-3-(3-oxobutyl)cyclohex-2-enone. selin-4,7(11)-diene. Dihydro-«beta»-ionene. 4-(1,2-Dimethyl-cyclopent-2-enyl)-butan-2-one. 1-Cyclohexene-1-carboxaldehyde, 2,6,6-trimethyl-. (4aS,8aS)-8-Isopentyl-4,4,7,8a-tetramethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene. cis-Megastigma-5,8-diene-4-one. 5.alpha.-Stigmast-8(14)-en-3-one. 6S-2,3,8,8-Tetramethyltricyclo[5.2.2.0(1,6)]undec-2-ene.

Find more compounds similar to 2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-.

Sources

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