Chemical Properties of Cyclohexanebutanal, 2-methyl-3-oxo-, cis- (CAS 92485-93-3)

Cyclohexanebutanal, 2-methyl-3-oxo-, cis-

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InChI
InChI=1S/C11H18O2/c1-9-10(5-2-3-8-12)6-4-7-11(9)13/h8-10H,2-7H2,1H3/t9-,10-/m0/s1
InChI Key
NQONHVHHNWFPMU-UWVGGRQHSA-N
Formula
C11H18O2
SMILES
CC1C(=O)CCCC1CCCC=O
Molecular Weight1
182.26
CAS
92485-93-3
Other Names
  • 4-(2-Methyl-3-oxocyclohexyl)butanal
Sources

Physical Properties

Property Value Unit Source
Δf -163.63 kJ/mol Joback Calculated Property
Δfgas -459.67 kJ/mol Joback Calculated Property
Δfus 18.95 kJ/mol Joback Calculated Property
Δvap 51.17 kJ/mol Joback Calculated Property
logPoct/wat 2.36 Crippen Calculated Property
Pc 2517.59 kPa Joback Calculated Property
Tboil 582.44 K Joback Calculated Property
Tc 795.55 K Joback Calculated Property
Tfus 327.09 K Joback Calculated Property
Vc 0.61 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 413.50 J/mol×K 582.44 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Cyclohexanone, 3-ethyl-2-methyl-, trans-. cis-2-Methyl-3-ethylcyclohexanone. Cyclohexanone, 5-methyl-2-(1-methylethyl)-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, cis-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, trans-. Bisabol-1-one. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2S-cis)-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R-cis)-. 1-Decalone (cis-trans). 1(2H)-Naphthalenone, octahydro-, trans-. [1,1'-Bicyclohexyl]-2-one. Cyclohexanone, 2-ethyl-3-methyl-, trans-. 2-hexylcyclohexan-1-one. Cyclohexanone, 2-(1-methylethyl)-. Cyclohexanone, sec-butyl, # 1.

Find more compounds similar to Cyclohexanebutanal, 2-methyl-3-oxo-, cis-.

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