Chemical Properties of Ethyl 2-bromodecanoate

InChI

InChI=1S/C12H23BrO2/c1-3-5-6-7-8-9-10-11(13)12(14)15-4-2/h11H,3-10H2,1-2H3

InChI Key

IOOXHTJCOQWOJW-UHFFFAOYSA-N

Formula

C12H23BrO2

SMILES

CCCCCCCCC(Br)C(=O)OCC

Molecular Weight¹

279.22

Other Names

• Ethyl 2-bromodecanoate

• ω : Acentric Factor.
• 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).
• 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
ω	0.6974		Relay (1.0) Calculated Property
ΔfH°gas	-590.66	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.97	kJ/mol	Joback Calculated Property
ΔvapH°	74.89	kJ/mol	Relay (1.0) Calculated Property
log10WS	-4.78		Relay (1.0) Calculated Property
logPoct/wat	4.064		Crippen Calculated Property
McVol	204.880	ml/mol	McGowan Calculated Property
Pc	1910.24	kPa	Joback Calculated Property
Inp	[1587.00; 1682.00]
Inp	1682.00		NIST
Inp	1587.00		NIST
Inp	1682.00		NIST
Tboil	538.22	K	Relay (1.0) Calculated Property
Tc	723.84	K	Relay (1.0) Calculated Property
Tfus	271.27	K	Relay (1.0) Calculated Property
Vc	0.764	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Ionization energy 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[506.90; 588.82]	J/mol×K	[598.10; 780.76]
Cp,gas	506.90	J/mol×K	598.10	Joback Calculated Property
Cp,gas	522.37	J/mol×K	628.54	Joback Calculated Property
Cp,gas	537.09	J/mol×K	658.99	Joback Calculated Property
Cp,gas	551.08	J/mol×K	689.43	Joback Calculated Property
Cp,gas	564.35	J/mol×K	719.87	Joback Calculated Property
Cp,gas	576.92	J/mol×K	750.32	Joback Calculated Property
Cp,gas	588.82	J/mol×K	780.76	Joback Calculated Property
η	[0.0001481; 0.0040048]	Pa×s	[312.13; 598.10]
η	0.0040048	Pa×s	312.13	Joback Calculated Property
η	0.0016062	Pa×s	359.79	Joback Calculated Property
η	0.0007977	Pa×s	407.45	Joback Calculated Property
η	0.0004587	Pa×s	455.11	Joback Calculated Property
η	0.0002930	Pa×s	502.78	Joback Calculated Property
η	0.0002022	Pa×s	550.44	Joback Calculated Property
η	0.0001481	Pa×s	598.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to Ethyl 2-bromodecanoate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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