Chemical Properties of 2-N-heptylcyclopentanone (CAS 137-03-1)

2-N-heptylcyclopentanone

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InChI
InChI=1S/C12H22O/c1-2-3-4-5-6-8-11-9-7-10-12(11)13/h11H,2-10H2,1H3
InChI Key
PJXHBTZLHITWFX-UHFFFAOYSA-N
Formula
C12H22O
SMILES
CCCCCCCC1CCCC1=O
Molecular Weight1
182.30
CAS
137-03-1
Other Names
  • 2-Heptylcyclopentan-1-one
  • 2-Heptylcyclopentanone
  • Alismone
  • Cyclopentanone, 2-heptyl-
  • Cyclopentanone, 2-n-heptyl-
  • «alpha»-Heptyl cyclopentanone
Sources

Physical Properties

Property Value Unit Source
Δf -35.88 kJ/mol Joback Calculated Property
Δfgas -368.23 kJ/mol Joback Calculated Property
Δfus 20.28 kJ/mol Joback Calculated Property
Δvap 46.81 kJ/mol Joback Calculated Property
logPoct/wat 3.72 Crippen Calculated Property
Pc 2153.30 kPa Joback Calculated Property
Tboil 557.06 K Joback Calculated Property
Tc 756.95 K Joback Calculated Property
Tfus 304.12 K Joback Calculated Property
Vc 0.66 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 435.75 J/mol×K 557.06 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CH2- 6
-CH3 1
>CH- (ring) 1
-CH2- (ring) 3
>C=O (ring) 1

Similar Compounds

Bicyclo[4.2.1]nonan-9-one. 2,5-Diethyl cyclopentanone. 1-Propanone, 1-cyclohexyl-. 1-Butanone, 1-cyclohexyl-. Ethanone, 1-cyclododecyl-. Cyclohexanone, 2-butyl-. Bicyclo[3.2.1]octan-8-one. [1,1'-Bicyclopentyl]-2-one. Cyclooctanone, 2-methyl-. Methanone, dicyclohexyl-. Cyclohexanone, 2-ethyl-. Cyclohexanone, 2-propyl-. Cyclopentanone, 2-ethyl-. Cyclopentanone, 2-(1-methylpropyl)-. 3-Ethyl-4-octanone.

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