Chemical Properties of 2,5-Cyclohexadien-1-one, 4-ethyl-3,4-dimethyl- (CAS 17429-35-5)

2,5-Cyclohexadien-1-one, 4-ethyl-3,4-dimethyl-

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InChI
InChI=1S/C10H14O/c1-4-10(3)6-5-9(11)7-8(10)2/h5-7H,4H2,1-3H3
InChI Key
CQBBARRJOASBCR-UHFFFAOYSA-N
Formula
C10H14O
SMILES
CCC1(C)C=CC(=O)C=C1C
Molecular Weight1
150.22
CAS
17429-35-5
Other Names
  • 4-ethyl-3,4-dimethyl-2,5-cyclohexadien-1-one
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Physical Properties

Property Value Unit Source
ΔfG° -20.02 kJ/mol Joback Calculated Property
ΔfH°gas -213.78 kJ/mol Joback Calculated Property
ΔfusH° 8.76 kJ/mol Joback Calculated Property
ΔvapH° 42.62 kJ/mol Joback Calculated Property
log10WS -2.65 Crippen Calculated Property
logPoct/wat 2.488 Crippen Calculated Property
McVol 133.870 ml/mol McGowan Calculated Property
Pc 2966.57 kPa Joback Calculated Property
I 1629.00 NIST
Tboil 519.11 K Joback Calculated Property
Tc 747.52 K Joback Calculated Property
Tfus 316.00 K Joback Calculated Property
Vc 0.505 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [303.30; 386.88] J/mol×K [519.11; 747.52] Show Hide
Cp,gas 303.30 J/mol×K 519.11 Joback Calculated Property
Cp,gas 319.23 J/mol×K 557.18 Joback Calculated Property
Cp,gas 334.23 J/mol×K 595.25 Joback Calculated Property
Cp,gas 348.40 J/mol×K 633.31 Joback Calculated Property
Cp,gas 361.84 J/mol×K 671.38 Joback Calculated Property
Cp,gas 374.63 J/mol×K 709.45 Joback Calculated Property
Cp,gas 386.88 J/mol×K 747.52 Joback Calculated Property

Similar Compounds

2,5-Cyclohexadien-1-one, 3,4,4-trimethyl-. 11,12,13-tri-nor-cis-Eudesma-5,8-dien-7-one. 3-Buten-2-one, 4-(1,2,6,6-tetramethyl-2-cyclohexen-1-yl)-. 2,6,10-Cycloundecatrien-1-one, 2,6,9,9-tetramethyl-, (E,E,E)-. 4-(2,7,7-Trimethylbicyclo[3.2.1]hept-2-en-1-yl]but-3-en-2-one. 4-(2,7,7-Trimethylbicyclo[3.2.0]hept-2-en-1-yl)but-3-en-2-one. Zerumbodienone. «alpha»-Ionone. Ionone. «alpha»-Ionone. 2-Cyclohexen-1-one, 3,5,5-trimethyl-4-(3-oxo-1-butenyl)-. 3-Oxo-«alpha»-ionone. 2,2,6,7-tetramethylbicyclo[4.3.0]nona-4,7,9(1)-triene. (E)-4-((1R,5S)-2,5,6,6-Tetramethylcyclohex-2-en-1-yl)but-3-en-2-one-rel-. 6-Methyl ionone.

Find more compounds similar to 2,5-Cyclohexadien-1-one, 4-ethyl-3,4-dimethyl-.

Sources

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