Chemical Properties of Ethanol, 2-(4-bromophenoxy)- (CAS 34743-88-9)

InChI

InChI=1S/C8H9BrO2/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4,10H,5-6H2

InChI Key

QYIOGYCRGNHDNK-UHFFFAOYSA-N

Formula

C8H9BrO2

SMILES

OCCOc1ccc(Br)cc1

Molecular Weight¹

217.06

CAS

34743-88-9

Other Names

• «beta»-(p-Bromophenoxy)ethanol
• 2-(p-Bromophenoxy)ethanol
• 2-(4-Bromophenoxy)ethanol
• 2-(4'-Bromophenoxy)ethanol

• 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_boilr : Boiling point at reduced pressure (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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[162.38; 356.73]	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			1.49920e+01
Coefficient B			6.34400e-01
Coefficient C			-3.66360e-04
Coefficient D			7.37000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	162.38	J/mol×K	273.00	Calculated Property
Cp,gas	196.84	J/mol×K	353.78	Calculated Property
Cp,gas	227.54	J/mol×K	434.56	Calculated Property
Cp,gas	254.71	J/mol×K	515.33	Calculated Property
Cp,gas	278.59	J/mol×K	596.11	Calculated Property
Cp,gas	299.41	J/mol×K	676.89	Calculated Property
Cp,gas	317.40	J/mol×K	757.67	Calculated Property
Cp,gas	332.79	J/mol×K	838.44	Calculated Property
Cp,gas	345.83	J/mol×K	919.22	Calculated Property
Cp,gas	356.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0027002; 0.0001165]	Pa×s	[361.71; 563.73]	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			-1.46848e+01
Coefficient B			3.17234e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			361.71
Temperature range, max.			563.73
η	0.0027002	Pa×s	361.71	Calculated Property
η	0.0016175	Pa×s	384.16	Calculated Property
η	0.0010253	Pa×s	406.60	Calculated Property
η	0.0006817	Pa×s	429.05	Calculated Property
η	0.0004720	Pa×s	451.49	Calculated Property
η	0.0003384	Pa×s	473.94	Calculated Property
η	0.0002500	Pa×s	496.39	Calculated Property
η	0.0001896	Pa×s	518.83	Calculated Property
η	0.0001472	Pa×s	541.28	Calculated Property
η	0.0001165	Pa×s	563.73	Calculated Property

Similar Compounds

Find more compounds similar to Ethanol, 2-(4-bromophenoxy)-.

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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