Chemical Properties of 2-Bromo-4-cyclohexyl-phenol (CAS 15460-06-7)

InChI

InChI=1S/C12H15BrO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h6-9,14H,1-5H2

InChI Key

DSYPBKQKCSJRHB-UHFFFAOYSA-N

Formula

C12H15BrO

SMILES

Oc1ccc(C2CCCCC2)cc1Br

Molecular Weight¹

255.15

CAS

15460-06-7

• 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_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 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	[198.10; 533.42]	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			-9.39600e+01
Coefficient B			1.32030e+00
Coefficient C			-1.00192e-03
Coefficient D			3.09000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	198.10	J/mol×K	273.00	Calculated Property
Cp,gas	261.42	J/mol×K	353.78	Calculated Property
Cp,gas	315.94	J/mol×K	434.56	Calculated Property
Cp,gas	362.64	J/mol×K	515.33	Calculated Property
Cp,gas	402.51	J/mol×K	596.11	Calculated Property
Cp,gas	436.51	J/mol×K	676.89	Calculated Property
Cp,gas	465.62	J/mol×K	757.67	Calculated Property
Cp,gas	490.83	J/mol×K	838.44	Calculated Property
Cp,gas	513.10	J/mol×K	919.22	Calculated Property
Cp,gas	533.42	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006682; 0.0000276]	Pa×s	[442.84; 655.97]	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			-1.71211e+01
Coefficient B			4.34435e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			442.84
Temperature range, max.			655.97
η	0.0006682	Pa×s	442.84	Calculated Property
η	0.0004061	Pa×s	466.52	Calculated Property
η	0.0002590	Pa×s	490.20	Calculated Property
η	0.0001721	Pa×s	513.88	Calculated Property
η	0.0001186	Pa×s	537.56	Calculated Property
η	0.0000843	Pa×s	561.25	Calculated Property
η	0.0000617	Pa×s	584.93	Calculated Property
η	0.0000462	Pa×s	608.61	Calculated Property
η	0.0000353	Pa×s	632.29	Calculated Property
η	0.0000276	Pa×s	655.97	Calculated Property

Similar Compounds

Find more compounds similar to 2-Bromo-4-cyclohexyl-phenol.

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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