Chemical Properties of Propanoic acid, 2-chloro, nonyl ester

InChI

InChI=1S/C12H23ClO2/c1-3-4-5-6-7-8-9-10-15-12(14)11(2)13/h11H,3-10H2,1-2H3

InChI Key

OPUKQARDQCGBBY-UHFFFAOYSA-N

Formula

C12H23ClO2

SMILES

CCCCCCCCCOC(=O)C(C)Cl

Molecular Weight¹

234.76

Other Names

• Nonyl 2-chloropropanoate

• 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.
• I : 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°	-198.13	kJ/mol	Joback Calculated Property
ΔfH°gas	-556.83	kJ/mol	Joback Calculated Property
ΔfusH°	30.30	kJ/mol	Joback Calculated Property
ΔvapH°	55.46	kJ/mol	Joback Calculated Property
log10WS	-3.97		Crippen Calculated Property
logPoct/wat	3.907		Crippen Calculated Property
McVol	199.620	ml/mol	McGowan Calculated Property
Pc	1806.16	kPa	Joback Calculated Property
Inp	[1515.00; 1552.00]
Inp	1515.00		NIST
Inp	1521.00		NIST
Inp	1524.00		NIST
Inp	1525.00		NIST
Inp	1527.00		NIST
Inp	1520.00		NIST
Inp	1535.00		NIST
Inp	Outlier 1552.00		NIST
Inp	1534.00		NIST
Inp	1515.00		NIST
Inp	1520.00		NIST
I	[1869.00; 1934.00]
I	1885.00		NIST
I	1869.00		NIST
I	1913.00		NIST
I	1914.00		NIST
I	1922.00		NIST
I	1934.00		NIST
I	1885.00		NIST
I	1934.00		NIST
Tboil	587.24	K	Joback Calculated Property
Tc	764.85	K	Joback Calculated Property
Tfus	312.08	K	Joback Calculated Property
Vc	0.774	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[496.78; 579.10]	J/mol×K	[587.24; 764.85]
Cp,gas	496.78	J/mol×K	587.24	Joback Calculated Property
Cp,gas	512.13	J/mol×K	616.84	Joback Calculated Property
Cp,gas	526.82	J/mol×K	646.44	Joback Calculated Property
Cp,gas	540.84	J/mol×K	676.04	Joback Calculated Property
Cp,gas	554.22	J/mol×K	705.64	Joback Calculated Property
Cp,gas	566.97	J/mol×K	735.25	Joback Calculated Property
Cp,gas	579.10	J/mol×K	764.85	Joback Calculated Property
η	[0.0001665; 0.0034450]	Pa×s	[312.08; 587.24]
η	0.0034450	Pa×s	312.08	Joback Calculated Property
η	0.0015046	Pa×s	357.94	Joback Calculated Property
η	0.0007932	Pa×s	403.80	Joback Calculated Property
η	0.0004765	Pa×s	449.66	Joback Calculated Property
η	0.0003146	Pa×s	495.52	Joback Calculated Property
η	0.0002228	Pa×s	541.38	Joback Calculated Property
η	0.0001665	Pa×s	587.24	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propanoic acid, 2-chloro, nonyl ester.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.