Chemical Properties of 11-Bromoundecanoic acid

InChI

InChI=1S/C11H21BrO2/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10H2,(H,13,14)

InChI Key

IUDGNRWYNOEIKF-UHFFFAOYSA-N

Formula

C11H21BrO2

SMILES

O=C(O)CCCCCCCCCCBr

Molecular Weight¹

265.19

Other Names

• Undecanoic acid, 11-bromo-

• 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

Cheméo can also estimate Acentric Factor for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[266.44; 606.68]	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			5.68000e+00
Coefficient B			1.13780e+00
Coefficient C			-7.18600e-04
Coefficient D			1.81800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	266.44	J/mol×K	273.00	Calculated Property
Cp,gas	326.32	J/mol×K	353.78	Calculated Property
Cp,gas	379.34	J/mol×K	434.56	Calculated Property
Cp,gas	426.07	J/mol×K	515.33	Calculated Property
Cp,gas	467.09	J/mol×K	596.11	Calculated Property
Cp,gas	502.98	J/mol×K	676.89	Calculated Property
Cp,gas	534.31	J/mol×K	757.67	Calculated Property
Cp,gas	561.65	J/mol×K	838.44	Calculated Property
Cp,gas	585.58	J/mol×K	919.22	Calculated Property
Cp,gas	606.68	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0012316; 0.0002712]	Pa×s	[434.13; 597.74]	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			-1.22275e+01
Coefficient B			2.39992e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			434.13
Temperature range, max.			597.74
η	0.0012316	Pa×s	434.13	Calculated Property
η	0.0009862	Pa×s	452.31	Calculated Property
η	0.0008034	Pa×s	470.49	Calculated Property
η	0.0006646	Pa×s	488.67	Calculated Property
η	0.0005572	Pa×s	506.85	Calculated Property
η	0.0004730	Pa×s	525.02	Calculated Property
η	0.0004059	Pa×s	543.20	Calculated Property
η	0.0003518	Pa×s	561.38	Calculated Property
η	0.0003076	Pa×s	579.56	Calculated Property
η	0.0002712	Pa×s	597.74	Calculated Property

Similar Compounds

Find more compounds similar to 11-Bromoundecanoic acid.

Sources

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

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