Chemical Properties of 1,4-Methanonaphthalen-9-ol, 1,2,3,4-tetrahydro-, stereoisomer

InChI

InChI=1S/C11H12O/c12-11-9-5-6-10(11)8-4-2-1-3-7(8)9/h1-4,9-12H,5-6H2

InChI Key

HEKIGGFOVMNILV-UHFFFAOYSA-N

Formula

C11H12O

SMILES

OC1C2CCC1c1ccccc12

Molecular Weight¹

160.22

Other Names

• 1,4-Methanonaphthalen-9-ol, 1,2,3,4-tetrahydro-, anti-
• anti-7-Benzonorbornenol
• anti-7-Hydroxybenzonorbornene

• 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).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	21.43	kJ/mol	Joback Calculated Property
IE	[8.62; 8.80]	eV
IE	8.62 ± 0.02	eV	NIST
IE	8.80 ± 0.02	eV	NIST
logPoct/wat	2.022		Crippen Calculated Property
McVol	126.240	ml/mol	McGowan Calculated Property
Tfus	413.94	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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	[156.90; 448.29]	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			-1.10850e+02
Coefficient B			1.22930e+00
Coefficient C			-1.00056e-03
Coefficient D			3.30400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	156.90	J/mol×K	273.00	Calculated Property
Cp,gas	213.45	J/mol×K	353.78	Calculated Property
Cp,gas	261.52	J/mol×K	434.56	Calculated Property
Cp,gas	302.15	J/mol×K	515.33	Calculated Property
Cp,gas	336.39	J/mol×K	596.11	Calculated Property
Cp,gas	365.28	J/mol×K	676.89	Calculated Property
Cp,gas	389.88	J/mol×K	757.67	Calculated Property
Cp,gas	411.21	J/mol×K	838.44	Calculated Property
Cp,gas	430.33	J/mol×K	919.22	Calculated Property
Cp,gas	448.29	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0038921; 0.0007451]	Pa×s	[348.65; 553.96]	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			-1.00095e+01
Coefficient B			1.55521e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			348.65
Temperature range, max.			553.96
η	0.0038921	Pa×s	348.65	Calculated Property
η	0.0029594	Pa×s	371.46	Calculated Property
η	0.0023228	Pa×s	394.27	Calculated Property
η	0.0018720	Pa×s	417.09	Calculated Property
η	0.0015429	Pa×s	439.90	Calculated Property
η	0.0012961	Pa×s	462.71	Calculated Property
η	0.0011068	Pa×s	485.52	Calculated Property
η	0.0009586	Pa×s	508.34	Calculated Property
η	0.0008405	Pa×s	531.15	Calculated Property
η	0.0007451	Pa×s	553.96	Calculated Property

Similar Compounds

Find more compounds similar to 1,4-Methanonaphthalen-9-ol, 1,2,3,4-tetrahydro-, stereoisomer.

Sources

• Cheméo Relay (1.0)
• 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

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