Chemical Properties of Benzene, (2-bromoethoxy)- (CAS 589-10-6)

InChI

InChI=1S/C8H9BrO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,6-7H2

InChI Key

JJFOBACUIRKUPN-UHFFFAOYSA-N

Formula

C8H9BrO

SMILES

BrCCOc1ccccc1

Molecular Weight¹

201.06

CAS

589-10-6

Other Names

• Phenetole, «beta»-bromo-
• «beta»-Bromophenetole
• «beta»-Phenoxyethyl bromide
• (2-Bromoethoxy)benzene
• 1-Bromo-2-phenoxyethane
• 2-Bromoethyl phenyl ether
• 2-Phenoxyethyl bromide
• beta-Phenoxyethyl bromide
• NSC 8055

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	38.21	kJ/mol	Joback Calculated Property
ΔfH°gas	-77.81	kJ/mol	Joback Calculated Property
ΔfusH°	16.99	kJ/mol	Joback Calculated Property
ΔvapH°	44.52	kJ/mol	Joback Calculated Property
IE	[8.42; 8.49]	eV
IE	8.42	eV	NIST
IE	8.49 ± 0.05	eV	NIST
log10WS	-2.44		Crippen Calculated Property
logPoct/wat	2.460		Crippen Calculated Property
McVol	123.190	ml/mol	McGowan Calculated Property
Pc	3891.64	kPa	Joback Calculated Property
Tboil	497.70	K	Joback Calculated Property
Tc	723.71	K	Joback Calculated Property
Tfus	288.37	K	Joback Calculated Property
Vc	0.456	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[234.96; 295.56]	J/mol×K	[497.70; 723.71]
Cp,gas	234.96	J/mol×K	497.70	Joback Calculated Property
Cp,gas	246.81	J/mol×K	535.37	Joback Calculated Property
Cp,gas	257.92	J/mol×K	573.04	Joback Calculated Property
Cp,gas	268.33	J/mol×K	610.70	Joback Calculated Property
Cp,gas	278.05	J/mol×K	648.37	Joback Calculated Property
Cp,gas	287.12	J/mol×K	686.04	Joback Calculated Property
Cp,gas	295.56	J/mol×K	723.71	Joback Calculated Property
η	[0.0002494; 0.0022365]	Pa×s	[288.37; 497.70]
η	0.0022365	Pa×s	288.37	Joback Calculated Property
η	0.0012738	Pa×s	323.26	Joback Calculated Property
η	0.0008096	Pa×s	358.15	Joback Calculated Property
η	0.0005577	Pa×s	393.04	Joback Calculated Property
η	0.0004082	Pa×s	427.92	Joback Calculated Property
η	0.0003132	Pa×s	462.81	Joback Calculated Property
η	0.0002494	Pa×s	497.70	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Benzene, (2-bromoethoxy)-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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