Chemical Properties of Bicyclo[2.2.2]octane, 1-bromo- (CAS 7697-09-8)

Bicyclo[2.2.2]octane, 1-bromo-

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C8H13Br/c9-8-4-1-7(2-5-8)3-6-8/h7H,1-6H2
InChI Key
GKIJLFQCRFWQCZ-UHFFFAOYSA-N
Formula
C8H13Br
SMILES
BrC12CCC(CC1)CC2
Molecular Weight1
189.09
CAS
7697-09-8
Other Names
  • 1-Bromobicyclo[2.2.2]octane
Sources

Physical Properties

Property Value Unit Source
Δf 122.61 kJ/mol Joback Calculated Property
Δfgas -33.60 kJ/mol Joback Calculated Property
Δfus 7.53 kJ/mol Joback Calculated Property
Δvap 38.86 kJ/mol Joback Calculated Property
IE 9.40 ± 0.10 eV NIST
IE 9.67 eV NIST
logPoct/wat 3.10 Crippen Calculated Property
Pc 4098.62 kPa Joback Calculated Property
Tboil 470.86 K Joback Calculated Property
Tc 710.72 K Joback Calculated Property
Tfus 292.46 K Joback Calculated Property
Vc 0.44 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 246.97 J/mol×K 470.86 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

1-Bromoadamantane. Cyclohexane, 1-bromo-4-methyl-. 1,3-dibromoadamantane. 3,5-dimethyl-1-bromoadamantane. 1,3,5-Tribromoadamantane. Cyclohexane, 1-bromo-3-methyl-. Tricyclo[3.3.1.13,7]decane, 2-bromo-. 1,3-Dibromo-5,7-dimethyladamantane. 2-Bromo ethylcyclohexane. 2-Bromo-2-methylhexane. 2-Norbornyl bromide. exo-2-Bromonorbornane. 3-Bromooctane. Cyclooctyl bromide. 2-Bromo-6-methylheptane.

Find more compounds similar to Bicyclo[2.2.2]octane, 1-bromo-.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.