Chemical Properties of 1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)- (CAS 87480-42-0)

1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-

InChI
InChI=1S/C17H20/c1-2-9-5-8(1)14-12-7-13(15(9)14)17-11-4-3-10(6-11)16(12)17/h1-4,8-17H,5-7H2/t8-,9+,10-,11+,12-,13+,14+,15-,16-,17+
InChI Key
KVHGVQIXSZOTQM-JDEKWYGUSA-N
Formula
C17H20
SMILES
C1=CC2CC1C1C3CC(C21)C1C2C=CC(C2)C31
Molecular Weight1
224.34
CAS
87480-42-0
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Physical Properties

Property Value Unit Source
ΔfH°gas 234.80 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.42 kJ/mol Joback Calculated Property
ΔvapH° 78.91 kJ/mol Relay (1.0) Calculated Property
IE 8.36 eV NIST
logPoct/wat 3.513 Crippen Calculated Property
McVol 176.630 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [226.46; 737.06] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.69580e+02
Coefficient B2.31580e+00
Coefficient C-2.02156e-03
Coefficient D7.12400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 226.46 J/mol×K 273.00 Calculated Property
Cp,gas 328.23 J/mol×K 353.78 Calculated Property
Cp,gas 413.48 J/mol×K 434.56 Calculated Property
Cp,gas 484.46 J/mol×K 515.33 Calculated Property
Cp,gas 543.44 J/mol×K 596.11 Calculated Property
Cp,gas 592.66 J/mol×K 676.89 Calculated Property
Cp,gas 634.39 J/mol×K 757.67 Calculated Property
Cp,gas 670.86 J/mol×K 838.44 Calculated Property
Cp,gas 704.33 J/mol×K 919.22 Calculated Property
Cp,gas 737.06 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0048840; 0.0538924] Pa×s [377.07; 580.98] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A1.51919e+00
Coefficient B-2.57953e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.377.07
Temperature range, max.580.98
η 0.0048840 Pa×s 377.07 Calculated Property
η 0.0071974 Pa×s 399.73 Calculated Property
η 0.0101743 Pa×s 422.38 Calculated Property
η 0.0138845 Pa×s 445.04 Calculated Property
η 0.0183855 Pa×s 467.70 Calculated Property
η 0.0237219 Pa×s 490.35 Calculated Property
η 0.0299260 Pa×s 513.01 Calculated Property
η 0.0370179 Pa×s 535.67 Calculated Property
η 0.0450070 Pa×s 558.32 Calculated Property
η 0.0538924 Pa×s 580.98 Calculated Property

Similar Compounds

1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«alpha»,9a«beta»,10«alpha»,10a«beta»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8-Dimethanonaphthalene,1,4,4a,5,8,8a-hexahydro-,(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»)-. 1,4,5,8-Dimethanonaphthalene, 1,4,4a,5,8,8a-hexahydro-, (1«alpha»,4«alpha»,4a«beta»,5«alpha»,8«alpha»,8a«beta»)-. 1,4:5,8-Dimethanonaphthalene,1,4,4a,5,8,8a-hexahydro-,(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»)-. Dicyclopenta[cd,gh]pentalene, 2a,3,3a,5a,6,6a,6b,6c-octahydro-. 1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«beta»,5«beta»,8«beta»,8a«beta»,9«alpha»,9a«beta»,10«alpha»,10a«beta»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»8a«alpha»,9.beta,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8-dimethano-naphthalene,1,2,4,4a,8,8,8a-octahydro-. 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,4a,5,8,8a-octahydro-, (1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»)-. 1,4:5,8-Dimethanonaphthalene, (1 alpha,4 alpha,4a beta,5 alpha,8 alpha,8a beta) 1,2,3,4,4a,5,8,8a-octahydro-. 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,4a,5,8,8a-octahydro-, (1«alpha»,4«alpha»,5«beta»,8«beta»)-. Dicyclopentadiene, 1,2-dihydro, exo. Dicyclopentadiene, 1,2-dihydro, endo.

Find more compounds similar to 1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-.

Sources

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