Chemical Properties of Bicyclo[3.1.1]hept-2-en-6-one, 2,7,7-trimethyl- (CAS 473-06-3)

Bicyclo[3.1.1]hept-2-en-6-one, 2,7,7-trimethyl-

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InChI
InChI=1S/C10H14O/c1-6-4-5-7-9(11)8(6)10(7,2)3/h4,7-8H,5H2,1-3H3
InChI Key
IECBDTGWSQNQID-UHFFFAOYSA-N
Formula
C10H14O
SMILES
CC1=CCC2C(=O)C1C2(C)C
Molecular Weight1
150.22
CAS
473-06-3
Other Names
  • 2-Pinen-7-one
  • Chrysantenone
  • Chrysanthenone
  • Crysanthenone
  • Isochrysanthenone
Sources

Physical Properties

Property Value Unit Source
Δf 27.26 kJ/mol Joback Calculated Property
Δfgas -206.78 kJ/mol Joback Calculated Property
Δfus 10.94 kJ/mol Joback Calculated Property
Δvap 41.59 kJ/mol Joback Calculated Property
logPoct/wat 2.18 Crippen Calculated Property
Pc 3002.44 kPa Joback Calculated Property
Tboil 513.48 K Joback Calculated Property
Tc 740.08 K Joback Calculated Property
Tfus 335.98 K Joback Calculated Property
Vc 0.49 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 307.39 J/mol×K 513.48 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>C=O (ring) 1
=CH- (ring) 1
=C< (ring) 1
>C< (ring) 1
-CH3 3
>CH- (ring) 2
-CH2- (ring) 1

Similar Compounds

.ALPHA.-damascone. 4,7,7-Trimethylbicyclo[3.2.0]hept-3-en-6-one. Filifolone. Bicyclo[3.1.1]hept-3-en-2-one, 4,6,6-trimethyl-, (1S)-. D-Verbenone. Bicyclo[3.1.1]hept-3-en-2-one, 4,6,6-trimethyl-. 2-Buten-1-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (e)-. Longiverbenone. «alpha»-Longipinen-2-one (Vulgarone B). Mustakone. 8-Isopropyl-1,5-dimethyltricyclo[4.4.0.02,7]dec-4-en-3-one. 2-Cyclohexen-1-one, 3,5,5-trimethyl-4-(1-oxo-2-butenyl). 8-Ketocopaenal. 8-Ketoylangenal. 3-Carene, 2-acetyl-.

Find more compounds similar to Bicyclo[3.1.1]hept-2-en-6-one, 2,7,7-trimethyl-.

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