Chemical Properties of 3-Chloropropionic acid, undec-2-enyl ester

InChI

InChI=1S/C14H25ClO2/c1-2-3-4-5-6-7-8-9-10-13-17-14(16)11-12-15/h9-10H,2-8,11-13H2,1H3/b10-9+

InChI Key

SRHPHYGOUXFJTB-MDZDMXLPSA-N

Formula

C14H25ClO2

SMILES

CCCCCCCC/C=C/COC(=O)CCCl

Molecular Weight¹

260.81

• 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).
• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[318.21; 727.40]	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			1.42800e+01
Coefficient B			1.30582e+00
Coefficient C			-7.47400e-04
Coefficient D			1.54700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	318.21	J/mol×K	273.00	Calculated Property
Cp,gas	389.56	J/mol×K	353.78	Calculated Property
Cp,gas	453.29	J/mol×K	434.56	Calculated Property
Cp,gas	509.90	J/mol×K	515.33	Calculated Property
Cp,gas	559.88	J/mol×K	596.11	Calculated Property
Cp,gas	603.71	J/mol×K	676.89	Calculated Property
Cp,gas	641.89	J/mol×K	757.67	Calculated Property
Cp,gas	674.91	J/mol×K	838.44	Calculated Property
Cp,gas	703.25	J/mol×K	919.22	Calculated Property
Cp,gas	727.40	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0032509; 0.0001628]	Pa×s	[314.71; 557.04]	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			-1.26112e+01
Coefficient B			2.16596e+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.			314.71
Temperature range, max.			557.04
η	0.0032509	Pa×s	314.71	Calculated Property
η	0.0018899	Pa×s	341.64	Calculated Property
η	0.0011893	Pa×s	368.56	Calculated Property
η	0.0007971	Pa×s	395.49	Calculated Property
η	0.0005622	Pa×s	422.41	Calculated Property
η	0.0004135	Pa×s	449.34	Calculated Property
η	0.0003149	Pa×s	476.26	Calculated Property
η	0.0002468	Pa×s	503.19	Calculated Property
η	0.0001984	Pa×s	530.11	Calculated Property
η	0.0001628	Pa×s	557.04	Calculated Property

Similar Compounds

Find more compounds similar to 3-Chloropropionic acid, undec-2-enyl ester.

Sources

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

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