Chemical Properties of 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,5,8-hexahydro-, (1«alpha»,4«alpha»,5«alpha»,8«alpha»)- (CAS 73365-00-1)

InChI

InChI=1S/C12H14/c1-2-8-5-7(1)11-9-3-4-10(6-9)12(8)11/h1-2,7-10H,3-6H2/t7-,8-,9+,10+/m0/s1

InChI Key

QUKNLCCMKRXCSW-AXTSPUMRSA-N

Formula

C12H14

SMILES

C1=CC2CC1C1=C2C2CCC1C2

Molecular Weight¹

158.24

CAS

73365-00-1

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	21.04	kJ/mol	Joback Calculated Property
IE	[7.50; 7.87]	eV
IE	7.50	eV	NIST
IE	7.87	eV	NIST
logPoct/wat	2.919		Crippen Calculated Property
McVol	127.900	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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[158.43; 488.69]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.64830e+02
Coefficient B			1.51640e+00
Coefficient C			-1.35028e-03
Coefficient D			4.87400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	158.43	J/mol×K	273.00	Calculated Property
Cp,gas	224.22	J/mol×K	353.78	Calculated Property
Cp,gas	279.14	J/mol×K	434.56	Calculated Property
Cp,gas	324.73	J/mol×K	515.33	Calculated Property
Cp,gas	362.54	J/mol×K	596.11	Calculated Property
Cp,gas	394.10	J/mol×K	676.89	Calculated Property
Cp,gas	420.95	J/mol×K	757.67	Calculated Property
Cp,gas	444.64	J/mol×K	838.44	Calculated Property
Cp,gas	466.70	J/mol×K	919.22	Calculated Property
Cp,gas	488.69	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0011801; 0.0033668]	Pa×s	[323.32; 512.91]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-3.90586e+00
Coefficient B			-9.17040e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			323.32
Temperature range, max.			512.91
η	0.0011801	Pa×s	323.32	Calculated Property
η	0.0014036	Pa×s	344.39	Calculated Property
η	0.0016365	Pa×s	365.45	Calculated Property
η	0.0018763	Pa×s	386.52	Calculated Property
η	0.0021211	Pa×s	407.58	Calculated Property
η	0.0023691	Pa×s	428.65	Calculated Property
η	0.0026188	Pa×s	449.71	Calculated Property
η	0.0028690	Pa×s	470.78	Calculated Property
η	0.0031186	Pa×s	491.84	Calculated Property
η	0.0033668	Pa×s	512.91	Calculated Property

Similar Compounds

Find more compounds similar to 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,5,8-hexahydro-, (1«alpha»,4«alpha»,5«alpha»,8«alpha»)-.

Sources

• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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.
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