Chemical Properties of Propane, 1-bromo-3-ethoxy- (CAS 36865-40-4)

InChI

InChI=1S/C5H11BrO/c1-2-7-5-3-4-6/h2-5H2,1H3

InChI Key

JOZWPJGRGUOZGY-UHFFFAOYSA-N

Formula

C5H11BrO

SMILES

CCOCCCBr

Molecular Weight¹

167.04

CAS

36865-40-4

Other Names

• 3-ethoxypropyl bromide

• 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).
• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (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°	-99.46	kJ/mol	Joback Calculated Property
ΔfH°gas	-252.42	kJ/mol	Joback Calculated Property
ΔfusH°	15.18	kJ/mol	Joback Calculated Property
ΔvapH°	35.57	kJ/mol	Joback Calculated Property
log10WS	-1.43		Crippen Calculated Property
logPoct/wat	1.808		Crippen Calculated Property
McVol	104.680	ml/mol	McGowan Calculated Property
Pc	3690.97	kPa	Joback Calculated Property
Inp	[880.80; 890.80]
Inp	890.80		NIST
Inp	880.80		NIST
Tboil	421.65 ± 2.50	K	NIST
Tc	587.20	K	Joback Calculated Property
Tfus	228.14	K	Joback Calculated Property
Vc	0.396	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[182.67; 232.18]	J/mol×K	[402.38; 587.20]
Cp,gas	182.67	J/mol×K	402.38	Joback Calculated Property
Cp,gas	191.72	J/mol×K	433.18	Joback Calculated Property
Cp,gas	200.45	J/mol×K	463.99	Joback Calculated Property
Cp,gas	208.85	J/mol×K	494.79	Joback Calculated Property
Cp,gas	216.94	J/mol×K	525.59	Joback Calculated Property
Cp,gas	224.71	J/mol×K	556.39	Joback Calculated Property
Cp,gas	232.18	J/mol×K	587.20	Joback Calculated Property
η	[0.0003128; 0.0029827]	Pa×s	[228.14; 402.38]
η	0.0029827	Pa×s	228.14	Joback Calculated Property
η	0.0016566	Pa×s	257.18	Joback Calculated Property
η	0.0010367	Pa×s	286.22	Joback Calculated Property
η	0.0007073	Pa×s	315.26	Joback Calculated Property
η	0.0005147	Pa×s	344.30	Joback Calculated Property
η	0.0003935	Pa×s	373.34	Joback Calculated Property
η	0.0003128	Pa×s	402.38	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propane, 1-bromo-3-ethoxy-.

Sources

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

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