Chemical Properties of 5H-Dibenzo(a,d)cyclohepten-5-ol (CAS 10354-00-4)

InChI

InChI=1S/C15H12O/c16-15-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)15/h1-10,15-16H

InChI Key

SRIISEYIFDTFRZ-UHFFFAOYSA-N

Formula

C15H12O

SMILES

OC1c2ccccc2C=Cc2ccccc21

Molecular Weight¹

208.26

CAS

10354-00-4

Other Names

• 5-Hydroxy-5H-dibenzo[a,d]cycloheptene
• 5H-Dibenzo[a,d]-1-cyclohepten-5-ol
• Dibenzosuberenol
• dibenzo[b,f]cyclohepten-1-ol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• 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

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, 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	[196.86; 517.17]	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			-8.71300e+01
Coefficient B			1.28090e+00
Coefficient C			-9.58400e-04
Coefficient D			2.81800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	196.86	J/mol×K	273.00	Calculated Property
Cp,gas	258.55	J/mol×K	353.78	Calculated Property
Cp,gas	311.63	J/mol×K	434.56	Calculated Property
Cp,gas	357.01	J/mol×K	515.33	Calculated Property
Cp,gas	395.56	J/mol×K	596.11	Calculated Property
Cp,gas	428.17	J/mol×K	676.89	Calculated Property
Cp,gas	455.75	J/mol×K	757.67	Calculated Property
Cp,gas	479.19	J/mol×K	838.44	Calculated Property
Cp,gas	499.36	J/mol×K	919.22	Calculated Property
Cp,gas	517.17	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0023852; 0.0001531]	Pa×s	[399.15; 656.59]	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			-1.30412e+01
Coefficient B			2.79515e+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.			399.15
Temperature range, max.			656.59
η	0.0023852	Pa×s	399.15	Calculated Property
η	0.0014933	Pa×s	427.75	Calculated Property
η	0.0009915	Pa×s	456.36	Calculated Property
η	0.0006909	Pa×s	484.96	Calculated Property
η	0.0005012	Pa×s	513.57	Calculated Property
η	0.0003761	Pa×s	542.17	Calculated Property
η	0.0002904	Pa×s	570.78	Calculated Property
η	0.0002299	Pa×s	599.38	Calculated Property
η	0.0001859	Pa×s	627.99	Calculated Property
η	0.0001531	Pa×s	656.59	Calculated Property

Similar Compounds

Find more compounds similar to 5H-Dibenzo(a,d)cyclohepten-5-ol.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• 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

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
These property values are available through the Cheméo API. A free account gives you an access key.