Chemical Properties of Benzenemethanol, alpha-cyclopropyl-alpha-phenyl- (CAS 5785-66-0)

InChI

InChI=1S/C16H16O/c17-16(15-11-12-15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2

InChI Key

MFKPHBJFWOOEDT-UHFFFAOYSA-N

Formula

C16H16O

SMILES

OC(c1ccccc1)(c1ccccc1)C1CC1

Molecular Weight¹

224.30

CAS

5785-66-0

Other Names

• alpha-cyclopropylbenzhydrylic alcohol

• 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).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[217.99; 607.61]	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			-1.48890e+02
Coefficient B			1.67670e+00
Coefficient C			-1.33140e-03
Coefficient D			4.11200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	217.99	J/mol×K	273.00	Calculated Property
Cp,gas	295.86	J/mol×K	353.78	Calculated Property
Cp,gas	362.05	J/mol×K	434.56	Calculated Property
Cp,gas	417.87	J/mol×K	515.33	Calculated Property
Cp,gas	464.60	J/mol×K	596.11	Calculated Property
Cp,gas	503.56	J/mol×K	676.89	Calculated Property
Cp,gas	536.04	J/mol×K	757.67	Calculated Property
Cp,gas	563.34	J/mol×K	838.44	Calculated Property
Cp,gas	586.76	J/mol×K	919.22	Calculated Property
Cp,gas	607.61	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0028970; 0.0001125]	Pa×s	[404.10; 667.28]	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			-1.40800e+01
Coefficient B			3.32813e+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.			404.10
Temperature range, max.			667.28
η	0.0028970	Pa×s	404.10	Calculated Property
η	0.0016618	Pa×s	433.34	Calculated Property
η	0.0010226	Pa×s	462.58	Calculated Property
η	0.0006667	Pa×s	491.83	Calculated Property
η	0.0004561	Pa×s	521.07	Calculated Property
η	0.0003248	Pa×s	550.31	Calculated Property
η	0.0002394	Pa×s	579.55	Calculated Property
η	0.0001817	Pa×s	608.80	Calculated Property
η	0.0001414	Pa×s	638.04	Calculated Property
η	0.0001125	Pa×s	667.28	Calculated Property

Similar Compounds

Find more compounds similar to Benzenemethanol, alpha-cyclopropyl-alpha-phenyl-.

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

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