Chemical Properties of Pentacyclo[3.3.3.02,4.06,8.09.11]undecane, stereoisomer (CAS 70469-89-5)

Pentacyclo[3.3.3.02,4.06,8.09.11]undecane, stereoisomer

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InChI
InChI=1S/C11H14/c1-4-5(1)11-7-2-6(7)10(4)8-3-9(8)11/h4-11H,1-3H2
InChI Key
TZRQBQARGUABOE-UHFFFAOYSA-N
Formula
C11H14
SMILES
C1C2C1C1C3CC3C2C2CC21
Molecular Weight1
146.23
CAS
70469-89-5
Other Names
  • Pentacyclo[3.3.3.0
Sources

Physical Properties

Property Value Unit Source
Δf 370.76 kJ/mol Joback Calculated Property
Δfgas 57.25 kJ/mol Joback Calculated Property
Δfus 26.53 kJ/mol Joback Calculated Property
Δvap 38.03 kJ/mol Joback Calculated Property
IE 8.60 eV NIST
IE 8.80 eV NIST
logPoct/wat 2.15 Crippen Calculated Property
Pc 3009.03 kPa Joback Calculated Property
Tboil 453.69 K Joback Calculated Property
Tc 656.71 K Joback Calculated Property
Tfus 304.79 K Joback Calculated Property
Vc 0.47 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 291.40 J/mol×K 453.69 Joback Calculated Property
η 0.01 Pa×s 453.69 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- (ring) 8
-CH2- (ring) 3

Similar Compounds

Pentacyclo[6.3.1.13,6.02,7.09,11]tridecane. Pentacyclo[6.3.1.0(2,7).0(3,5).0(9,11)]dodecane. Tetracyclo[6.1.0.02,4.05,7]nonane(1α,2α,4α,5β,7β,8α)-. Tetracyclo[6.2.1.0(2,7).o(3,5)]undecane. Tricyclo[3.2.1.02,4]octane,(1«alpha»,2«alpha»,4«alpha»,5«alpha»)-. Tricyclo[3.2.1.02,4]octane,(1«alpha»,2«beta»,4«beta»,5«alpha»)-. Tricyclo[3.2.1.02,4]octan-8-one,exo-. Tricyclo[3.2.1.02,4]octan-8-one,(1«alpha»,2«alpha»,4«alpha»,5«alpha»)-. Tricycloprop[cd,f,hi]indene,decahydro-,(1aα,1bα,1cβ,2aβ,2bα,2cα,2dα,2eα)-. Tetracyclo[7.1.0.02,4.05,7]decane(1«alpha»,2«alpha»,4«alpha»,5«beta»,7«alpha»,9«alpha»)-. Tetracyclo[7.1.0.02,4.05,7]decane(1«alpha»,2«alpha»,4«alpha»,5«alpha»,7«alpha»,9«alpha»)-. Tricyclo[6.1.0.0]nonane-(1«alpha»,2«beta»,4«beta»,8«alpha»)-. Tricyclo[6.1.0.0]nonane-(1«alpha»,2«alpha»,4«alpha»,8«alpha»)-. Tetracyclo[7.1.0.02,4.05,7]decane(1«alpha»,2«alpha»,4«beta»,5«alpha»,7«alpha»,9«alpha»)-. Tetracyclo[5.2.1.02,6.03,5]decane,(1α,2α,3β,5β,6α,7α)-.

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