Chemical Properties of 1-n-butyladamantane (CAS 14449-41-3)

1-n-butyladamantane

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InChI
InChI=1S/C14H24/c1-2-3-4-14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,2-10H2,1H3
InChI Key
AZCUIXHZJHFUFI-UHFFFAOYSA-N
Formula
C14H24
SMILES
CCCCC12CC3CC(CC(C3)C1)C2
Molecular Weight1
192.34
CAS
14449-41-3
Other Names
  • 1-Butyladamantane
Sources

Physical Properties

Property Value Unit Source
Δf 223.95 kJ/mol Joback Calculated Property
Δfgas -125.15 kJ/mol Joback Calculated Property
Δfus 19.09 kJ/mol Joback Calculated Property
Δvap 45.21 kJ/mol Joback Calculated Property
logPoct/wat 4.39 Crippen Calculated Property
Pc 2193.84 kPa Joback Calculated Property
Tboil 539.78 K Joback Calculated Property
Tc 749.54 K Joback Calculated Property
Tfus 317.50 K Joback Calculated Property
Vc 0.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 468.73 J/mol×K 539.78 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

1-ethyl-3,5,7-trimethyladamantane. 1,3-diethyl-5-methyladamantane. 1,3,5-Trimethyladamantane. 1-Methyl-3-ethyladamantane. Adamantane, 1,3-dimethyl-. Bis(ethylcyclohexyl)methane. 1-propyladamantane. 1-Ethyladamantane. 1,3,5,7-Tetramethyladamantane. 1,3-diethyl-5,7-dimethyladamantane. 5-methyl-adamantane. 1-Methyladamantane. 1,3-Diethyladamantane. 1,3-Dimethyl-5-ethyladamantane. 5,5,7,7-Tetraethylundecane.

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