Chemical Properties of 1,4:5,8-Dimethanonaphthalen-9-one, (1α,4α,4aα,5β,8β,8aα)- (CAS 36197-31-6)

1,4:5,8-Dimethanonaphthalen-9-one, (1α,4α,4aα,5β,8β,8aα)-

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InChI
InChI=1S/C12H16O/c13-12-8-3-4-9(12)11-7-2-1-6(5-7)10(8)11/h6-11H,1-5H2
InChI Key
BXCXSNWNIVXFED-UHFFFAOYSA-N
Formula
C12H16O
SMILES
O=C1C2CCC1C1C3CCC(C3)C21
Molecular Weight1
176.25
CAS
36197-31-6
Other Names
  • 1,4:5,8-Dimethanonaphthalen-9-one, (1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»)-
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Physical Properties

Property Value Unit Source
Δf 155.15 kJ/mol Joback Calculated Property
Δfgas -178.19 kJ/mol Joback Calculated Property
Δfus 21.03 kJ/mol Joback Calculated Property
Δvap 45.59 kJ/mol Joback Calculated Property
IE [8.50; 8.78] eV Show Hide
IE 8.50 eV NIST
IE 8.78 eV NIST
log10WS -2.25 Crippen Calculated Property
logPoct/wat 2.258 Crippen Calculated Property
McVol 138.070 ml/mol McGowan Calculated Property
Pc 2826.33 kPa Joback Calculated Property
Tboil 559.40 K Joback Calculated Property
Tc 790.88 K Joback Calculated Property
Tfus 356.50 K Joback Calculated Property
Vc 0.540 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [394.50; 501.63] J/mol×K [559.40; 790.88] Show Hide
Cp,gas 394.50 J/mol×K 559.40 Joback Calculated Property
Cp,gas 415.74 J/mol×K 597.98 Joback Calculated Property
Cp,gas 435.46 J/mol×K 636.56 Joback Calculated Property
Cp,gas 453.79 J/mol×K 675.14 Joback Calculated Property
Cp,gas 470.84 J/mol×K 713.72 Joback Calculated Property
Cp,gas 486.75 J/mol×K 752.30 Joback Calculated Property
Cp,gas 501.63 J/mol×K 790.88 Joback Calculated Property

Similar Compounds

Tricyclo[3.2.1.13,6]nonan-7-one. 4,7-Methano-5H-inden-5-one, octahydro-. exo-Tricyclo[6,2,1,0(2,6)]decan-8-one. endo-Tricyclo[6,2,1,0(2,6)]decan-8-one. 1H-Inden-1-one, octahydro-, cis-. 1H-Inden-1-one, octahydro-, trans-. 1H-Inden-1-one, octahydro-. [1,1'-Bicyclopentyl]-2-one. 1-{Bicyclo[2.2.1]heptan-2-yl}ethanone. Muurol-5-en-4-one. trans-Bicyclo[3.3.0]-octan-2-one. cis-Bicyclo[3.3.0]-octan-2-one. (Z)-8-Methyl-1-hydrindanone. 2-ethyl isomenthone. [1,1'-Bicyclohexyl]-2-one.

Find more compounds similar to 1,4:5,8-Dimethanonaphthalen-9-one, (1α,4α,4aα,5β,8β,8aα)-.

Sources

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