Chemical Properties of 2-Butanone, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)- (CAS 17283-81-7)

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

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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
194.31
CAS
17283-81-7
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
Δf -40.68 kJ/mol Joback Calculated Property
Δfgas -319.83 kJ/mol Joback Calculated Property
Δfus 17.01 kJ/mol Joback Calculated Property
Δvap 52.17 kJ/mol Joback Calculated Property
log10WS -4.05 Crippen Calculated Property
logPoct/wat 3.882 Crippen Calculated Property
McVol 180.440 ml/mol McGowan Calculated Property
Pc 2169.38 kPa Joback Calculated Property
Inp [1414.00; 1436.00]   Show Hide
Inp 1414.00 NIST
Inp 1436.00 NIST
I 1849.00 NIST
Tboil 579.62 K Joback Calculated Property
Tc 789.51 K Joback Calculated Property
Tfus 343.28 K Joback Calculated Property
Vc 0.686 m3/kmol Joback Calculated Property

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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