Chemical Properties of 1-((1S,3aR,4S,7R,7aR)-3a,7a-Dimethyloctahydro-1H-4,7-methanoinden-1-yl)ethanone (CAS 66748-84-3)

1-((1S,3aR,4S,7R,7aR)-3a,7a-Dimethyloctahydro-1H-4,7-methanoinden-1-yl)ethanone

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InChI
InChI=1S/C14H22O/c1-9(15)12-6-7-13(2)10-4-5-11(8-10)14(12,13)3/h10-12H,4-8H2,1-3H3
InChI Key
ZVJYJEILWCYOQE-UHFFFAOYSA-N
Formula
C14H22O
SMILES
CC(=O)C1CCC2(C)C3CCC(C3)C12C
Molecular Weight1
206.32
CAS
66748-84-3
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Physical Properties

Property Value Unit Source
Δf 81.83 kJ/mol Joback Calculated Property
Δfgas -242.83 kJ/mol Joback Calculated Property
Δfus 15.47 kJ/mol Joback Calculated Property
Δvap 50.50 kJ/mol Joback Calculated Property
log10WS -3.44 Crippen Calculated Property
logPoct/wat 3.428 Crippen Calculated Property
McVol 177.110 ml/mol McGowan Calculated Property
Pc 2356.49 kPa Joback Calculated Property
Inp 1589.40 NIST
Tboil 589.22 K Joback Calculated Property
Tc 815.60 K Joback Calculated Property
Tfus 387.09 K Joback Calculated Property
Vc 0.682 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [497.75; 608.72] J/mol×K [589.22; 815.60] Show Hide
Cp,gas 497.75 J/mol×K 589.22 Joback Calculated Property
Cp,gas 518.74 J/mol×K 626.95 Joback Calculated Property
Cp,gas 538.31 J/mol×K 664.68 Joback Calculated Property
Cp,gas 556.79 J/mol×K 702.41 Joback Calculated Property
Cp,gas 574.48 J/mol×K 740.14 Joback Calculated Property
Cp,gas 591.69 J/mol×K 777.87 Joback Calculated Property
Cp,gas 608.72 J/mol×K 815.60 Joback Calculated Property

Similar Compounds

Paludone. 5«alpha»-Dihydroprogesterone. Pregnane-3,20-dione, (5«beta»)-. (+)-(1S,3aR,7S,7aR)-2,3,3a,4,5,6,7,7a-Octahydro-7,7a-dimethyl-1-(2-methylpropanonyl)-1H-indene. Cholestan-6-one, (5«alpha»)-. 15-nor-Funebran-3-one. Bicyclo[2.2.1]heptan-2-one, 4,7,7-trimethyl-, (1R)-. Bicyclo[2.2.1]heptan-2-one, 4,7,7-trimethyl-, (1S)-. 15-nor-3-Gymnomitrone. 2H-2,4a-Methanonaphthalen-8(5H)-one, 1,3,4,6,7,8a-hexahydro-1,1,5,5-tetramethyl-. trans-Isolongifolanone. Faurinone. Bicyclo[2.2.1]heptan-2-one, 7,7-dimethyl-. Isocamphone. 9-Cedranone.

Find more compounds similar to 1-((1S,3aR,4S,7R,7aR)-3a,7a-Dimethyloctahydro-1H-4,7-methanoinden-1-yl)ethanone.

Sources

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