Chemical Properties of Bicyclo[4,2,1]non-3-ene (CAS 16456-33-0)

Bicyclo[4,2,1]non-3-ene

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InChI
InChI=1S/C9H14/c1-2-4-9-6-5-8(3-1)7-9/h1-2,8-9H,3-7H2
InChI Key
VQBSXAZGFWSWHD-UHFFFAOYSA-N
Formula
C9H14
SMILES
C1=CCC2CCC(C2)C1
Molecular Weight1
122.21
CAS
16456-33-0
Sources

Physical Properties

Property Value Unit Source
Δcsolid -5496.30 ± 0.90 kJ/mol NIST
Δf 140.06 kJ/mol Joback Calculated Property
Δfgas 3.60 ± 1.20 kJ/mol NIST
Δfsolid -46.10 ± 0.90 kJ/mol NIST
Δfus 10.26 kJ/mol Joback Calculated Property
Δsub 49.70 ± 0.80 kJ/mol NIST
Δsub 49.70 kJ/mol NIST
Δsub 49.70 ± 0.80 kJ/mol NIST
Δvap 36.26 kJ/mol Joback Calculated Property
logPoct/wat 2.75 Crippen Calculated Property
Pc 3415.86 kPa Joback Calculated Property
Tboil 430.77 K Joback Calculated Property
Tc 649.36 K Joback Calculated Property
Tfus 217.27 K Joback Calculated Property
Vc 0.42 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 226.80 J/mol×K 430.77 Joback Calculated Property
η 0.00 Pa×s 430.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- (ring) 2
-CH2- (ring) 5
=CH- (ring) 2

Similar Compounds

Bicyclo[3.2.1]oct-2-ene. 4-Cyclopentyl-cyclohexene. Bicycloheptyl-3,3'-diene. cis-Cyclodecene, 4-methyl. (E)-Cyclodecene, 4-methyl. (Z)-Cyclooctene, 4-methyl. Cyclooctene, 4-methyl. Cyclohexene,4-butyl-. 4-Methylcycloheptene. Bicyclooctyl-3,3'-diene. Bicyclononyl-3,3'-diene. Cyclopentane, 1-methyl-3-(2-methyl-2-propenyl)-. 4-Cyclohexyl-cycloheptene. Bicyclohexyl-3,3'-diene. Bicyclohexyl-3-ene.

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