Chemical Properties of 3,8-Methanocyclobuta[b]naphthalene,1,2,2a,3,8,8a-hexahydro-(2a«alpha»,3«alpha»,8«alpha»,8a«alpha»)- (CAS 67145-41-9)

3,8-Methanocyclobuta[b]naphthalene,1,2,2a,3,8,8a-hexahydro-(2a«alpha»,3«alpha»,8«alpha»,8a«alpha»)-

InChI
InChI=1S/C13H14/c1-2-4-9-8(3-1)12-7-13(9)11-6-5-10(11)12/h1-4,10-13H,5-7H2/t10-,11+,12+,13-
InChI Key
SHMYIFLHMQKIPZ-FNFFVJSTSA-N
Formula
C13H14
SMILES
c1ccc2c(c1)C1CC2C2CCC12
Molecular Weight1
170.25
CAS
67145-41-9
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 22.75 kJ/mol Joback Calculated Property
IE 8.46 ± 0.05 eV NIST
logPoct/wat 3.297 Crippen Calculated Property
McVol 137.690 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [351.57; 444.16] J/mol×K [535.51; 765.41] Show Hide
Cp,gas 351.57 J/mol×K 535.51 Joback Calculated Property
Cp,gas 370.37 J/mol×K 573.83 Joback Calculated Property
Cp,gas 387.60 J/mol×K 612.14 Joback Calculated Property
Cp,gas 403.44 J/mol×K 650.46 Joback Calculated Property
Cp,gas 418.04 J/mol×K 688.78 Joback Calculated Property
Cp,gas 431.56 J/mol×K 727.09 Joback Calculated Property
Cp,gas 444.16 J/mol×K 765.41 Joback Calculated Property
η [0.0014101; 0.0031647] Pa×s [331.83; 535.51] Show Hide
η 0.0014101 Pa×s 331.83 Joback Calculated Property
η 0.0017176 Pa×s 365.78 Joback Calculated Property
η 0.0020232 Pa×s 399.72 Joback Calculated Property
η 0.0023228 Pa×s 433.67 Joback Calculated Property
η 0.0026139 Pa×s 467.62 Joback Calculated Property
η 0.0028948 Pa×s 501.56 Joback Calculated Property
η 0.0031647 Pa×s 535.51 Joback Calculated Property

Similar Compounds

3,8-Methanocyclobuta[b]naphthalene,1,2,2a,3,8,8a-hexahydro-(2a«alpha»3«beta»,8«beta»,8a«alpha»)-. 2,7-Methano-1H-cyclopropa[b]naphthalene,1a,2,7,7a-tetrahydro-(1aα,2β,7β,7aα)-. 1,3,5(10)-Oestratriene. 1H-Indene, 2-butyl-1-hexyl-2,3-dihydro-. Fluorene, 1,2,3,4,4a,9a-hexahydro-, cis-. 1,2,3,4,4a,9,10,10a-Octahydrophenanthrene (trans). 1,2,3,4,4a,9,10,10a-Octahydrophenanthrene (cis). 1,3,5(10)-Oestratrien-17-one. 3-Ethyl-8,8,11a-trimethyl-2,3,6,7,7 a,8,9,10,11,11a-decahydro-1H-cyclopenta[a]chrysene. Estra-1,3,5(10)-trien-3-ol. 3-Ethyl-5b,8,8,11a-tetramethyl-2,3, 5b,6,7,7a,8,9,10,11,11a,11b,12,13-tetradecahydro-1H-cyclopenta[a]chrysene. 5,6,6a,7,8,12b,12c-Octahydrodibenzo[a,i]biphenylene. 3,8-Methanocyclobuta[b]naphthalene,2a,3,8,8a-tetrahydro-(2a«alpha»,3«alpha»,8«alpha»,8a«alpha»)-. 3,8-Methanocyclobuta[b]naphthalene,2a,3,8,8a-tetrahydro-((2a«alpha»,3«beta»,8«beta»,8a«alpha»)-. Chrysene, 1,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydro-.

Find more compounds similar to 3,8-Methanocyclobuta[b]naphthalene,1,2,2a,3,8,8a-hexahydro-(2a«alpha»,3«alpha»,8«alpha»,8a«alpha»)-.

Sources

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.
These property values are available through the Cheméo API. A free account gives you an access key.