Chemical Properties of Dodecanoyl chloride (CAS 112-16-3)

InChI

InChI=1S/C12H23ClO/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3

InChI Key

NQGIJDNPUZEBRU-UHFFFAOYSA-N

Formula

C12H23ClO

SMILES

CCCCCCCCCCCC(=O)Cl

Molecular Weight¹

218.76

CAS

112-16-3

Other Names

• Lauroyl chloride
• n-Dodecanoyl chloride
• Lauric acid, chloride
• Dodecanoic acid, chloride

• ω : Acentric Factor.
• 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

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[408.70; 418.20]	K	[1.50; 2.40]
Tboilr	408.70	K	1.50	NIST
Tboilr	418.20	K	2.40	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[274.38; 635.71]	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			1.22300e+01
Coefficient B			1.12262e+00
Coefficient C			-6.30700e-04
Coefficient D			1.31560e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	274.38	J/mol×K	273.00	Calculated Property
Cp,gas	336.28	J/mol×K	353.78	Calculated Property
Cp,gas	391.77	J/mol×K	434.56	Calculated Property
Cp,gas	441.26	J/mol×K	515.33	Calculated Property
Cp,gas	485.19	J/mol×K	596.11	Calculated Property
Cp,gas	523.95	J/mol×K	676.89	Calculated Property
Cp,gas	557.96	J/mol×K	757.67	Calculated Property
Cp,gas	587.65	J/mol×K	838.44	Calculated Property
Cp,gas	613.43	J/mol×K	919.22	Calculated Property
Cp,gas	635.71	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0037253; 0.0003025]	Pa×s	[304.85; 518.44]	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			-1.16870e+01
Coefficient B			1.85787e+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.			304.85
Temperature range, max.			518.44
η	0.0037253	Pa×s	304.85	Calculated Property
η	0.0023988	Pa×s	328.58	Calculated Property
η	0.0016390	Pa×s	352.31	Calculated Property
η	0.0011751	Pa×s	376.05	Calculated Property
η	0.0008764	Pa×s	399.78	Calculated Property
η	0.0006754	Pa×s	423.51	Calculated Property
η	0.0005352	Pa×s	447.24	Calculated Property
η	0.0004341	Pa×s	470.97	Calculated Property
η	0.0003593	Pa×s	494.70	Calculated Property
η	0.0003025	Pa×s	518.44	Calculated Property

Similar Compounds

Find more compounds similar to Dodecanoyl chloride.

Sources

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

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