Chemical Properties of 4-(2,7,7-Trimethylbicyclo[3.2.0]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

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InChI
InChI=1S/C14H20O/c1-10-5-6-12-9-13(3,4)14(10,12)8-7-11(2)15/h5,7-8,12H,6,9H2,1-4H3/b8-7-
InChI Key
ZXVDYQWETIMVLL-FPLPWBNLSA-N
Formula
C14H20O
SMILES
CC(=O)C=CC12C(C)=CCC1CC2(C)C
Molecular Weight1
204.31
Other Names
  • 4-(2',7',7'-Trimethyl-bicyclo[3.2.0]hept-2'-en-1'-yl)but-3-en-2-one
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Physical Properties

Property Value Unit Source
Δf 129.34 kJ/mol Joback Calculated Property
Δfgas -131.76 kJ/mol Joback Calculated Property
Δfus 17.29 kJ/mol Joback Calculated Property
Δvap 51.80 kJ/mol Joback Calculated Property
log10WS -3.73 Crippen Calculated Property
logPoct/wat 3.514 Crippen Calculated Property
McVol 179.370 ml/mol McGowan Calculated Property
Pc 2302.53 kPa Joback Calculated Property
Inp [1394.00; 1472.00]   Show Hide
Inp 1472.00 NIST
Inp 1394.00 NIST
Inp 1472.00 NIST
Tboil 595.45 K Joback Calculated Property
Tc 818.73 K Joback Calculated Property
Tfus 381.59 K Joback Calculated Property
Vc 0.693 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [470.23; 565.70] J/mol×K [595.45; 818.73] Show Hide
Cp,gas 470.23 J/mol×K 595.45 Joback Calculated Property
Cp,gas 487.97 J/mol×K 632.66 Joback Calculated Property
Cp,gas 504.61 J/mol×K 669.88 Joback Calculated Property
Cp,gas 520.43 J/mol×K 707.09 Joback Calculated Property
Cp,gas 535.69 J/mol×K 744.30 Joback Calculated Property
Cp,gas 550.69 J/mol×K 781.52 Joback Calculated Property
Cp,gas 565.70 J/mol×K 818.73 Joback Calculated Property

Similar Compounds

4-(2,7,7-Trimethylbicyclo[3.2.1]hept-2-en-1-yl]but-3-en-2-one. 3-Buten-2-one, 4-(1,2,6,6-tetramethyl-2-cyclohexen-1-yl)-. «alpha»-Acoradiene. Trinoranastreptene. 13-nor-Eremophila-1(10),6-dien-11-one. 6-Methyl ionone. trans-«alpha»-Irone. (E)-4-((1R,5S)-2,5,6,6-Tetramethylcyclohex-2-en-1-yl)but-3-en-2-one-rel-. cis-«alpha»-Irone. «alpha»-Irone. Ionone. «alpha»-Ionone. «alpha»-Ionone. «alpha»-Vetispirene. 2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-, (4ar-cis)-.

Find more compounds similar to 4-(2,7,7-Trimethylbicyclo[3.2.0]hept-2-en-1-yl)but-3-en-2-one.

Sources

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