Chemical Properties of 8-Ketoylangenal (CAS 136458-94-1)

8-Ketoylangenal

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InChI
InChI=1S/C15H20O2/c1-8(2)12-11(17)6-15(3)10-5-4-9(7-16)14(15)13(10)12/h4,7-8,10,12-14H,5-6H2,1-3H3
InChI Key
USHAYNWHSSDBMV-UHFFFAOYSA-N
Formula
C15H20O2
SMILES
CC(C)C1C(=O)CC2(C)C3CC=C(C=O)C2C13
Molecular Weight1
232.32
CAS
136458-94-1
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Physical Properties

Property Value Unit Source
Δf 20.44 kJ/mol Joback Calculated Property
Δfgas -348.38 kJ/mol Joback Calculated Property
Δfus 21.86 kJ/mol Joback Calculated Property
Δvap 58.66 kJ/mol Joback Calculated Property
log10WS -2.75 Crippen Calculated Property
logPoct/wat 2.629 Crippen Calculated Property
McVol 188.470 ml/mol McGowan Calculated Property
Pc 2212.45 kPa Joback Calculated Property
Inp [1825.80; 1825.80]   Show Hide
Inp 1825.80 NIST
Inp 1825.80 NIST
Tboil 678.17 K Joback Calculated Property
Tc 906.45 K Joback Calculated Property
Tfus 433.03 K Joback Calculated Property
Vc 0.739 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [567.73; 671.52] J/mol×K [678.17; 906.45] Show Hide
Cp,gas 567.73 J/mol×K 678.17 Joback Calculated Property
Cp,gas 586.89 J/mol×K 716.22 Joback Calculated Property
Cp,gas 605.06 J/mol×K 754.26 Joback Calculated Property
Cp,gas 622.44 J/mol×K 792.31 Joback Calculated Property
Cp,gas 639.18 J/mol×K 830.36 Joback Calculated Property
Cp,gas 655.48 J/mol×K 868.40 Joback Calculated Property
Cp,gas 671.52 J/mol×K 906.45 Joback Calculated Property

Similar Compounds

8-Ketocopaenal. Ylangenal. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-, (1S)-. (1R)-(-)-Myrtenal. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-. 8-Isopropyl-1,5-dimethyltricyclo[4.4.0.02,7]dec-4-en-3-one. Mustakone. «alpha»-Longipinen-2-one (Vulgarone B). Longiverbenone. Lophenone. Polygodial. «alpha»-cedrenal. (3R,3aR,7S,8aS)-3,6,8,8-Tetramethyl-4,7,8,8a-tetrahydro-1H-3a,7-methanoazulen-2(3H)-one. Filifolone. 4,7,7-Trimethylbicyclo[3.2.0]hept-3-en-6-one.

Find more compounds similar to 8-Ketoylangenal.

Sources

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