Chemical Properties of Myristin, 2,3-diaceto-1- (CAS 14473-55-3)

InChI

InChI=1S/C21H38O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-21(24)26-17-20(27-19(3)23)16-25-18(2)22/h20H,4-17H2,1-3H3

InChI Key

WPZADTFNTUIQLK-UHFFFAOYSA-N

Formula

C21H38O6

SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(C)=O)OC(C)=O

Molecular Weight¹

386.52

CAS

14473-55-3

Other Names

• Tetradecanoic acid, 2,3-bis(acetyloxy)propyl ester
• 2,3-Bis(acetyloxy)propyl myristate
• 1-Myristo-2,3-diacetin
• Glycerol, 1-tetradecanoate, diacetate

• 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.
• 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°	-578.26	kJ/mol	Joback Calculated Property
ΔfH°gas	-1216.45	kJ/mol	Joback Calculated Property
ΔfusH°	54.98	kJ/mol	Joback Calculated Property
ΔvapH°	89.42	kJ/mol	Joback Calculated Property
log10WS	-5.31		Crippen Calculated Property
logPoct/wat	4.725		Crippen Calculated Property
McVol	329.070	ml/mol	McGowan Calculated Property
Pc	1048.69	kPa	Joback Calculated Property
Inp	[2471.00; 2471.00]
Inp	2471.00		NIST
Inp	2471.00		NIST
Tboil	908.31	K	Joback Calculated Property
Tc	1112.06	K	Joback Calculated Property
Tfus	527.91	K	Joback Calculated Property
Vc	1.278	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1083.61; 1163.93]	J/mol×K	[908.31; 1112.06]
Cp,gas	1083.61	J/mol×K	908.31	Joback Calculated Property
Cp,gas	1100.42	J/mol×K	942.27	Joback Calculated Property
Cp,gas	1115.85	J/mol×K	976.23	Joback Calculated Property
Cp,gas	1129.91	J/mol×K	1010.19	Joback Calculated Property
Cp,gas	1142.60	J/mol×K	1044.15	Joback Calculated Property
Cp,gas	1153.94	J/mol×K	1078.10	Joback Calculated Property
Cp,gas	1163.93	J/mol×K	1112.06	Joback Calculated Property
η	[0.0000295; 0.0004481]	Pa×s	[527.91; 908.31]
η	0.0004481	Pa×s	527.91	Joback Calculated Property
η	0.0002232	Pa×s	591.31	Joback Calculated Property
η	0.0001273	Pa×s	654.71	Joback Calculated Property
η	0.0000801	Pa×s	718.11	Joback Calculated Property
η	0.0000544	Pa×s	781.51	Joback Calculated Property
η	0.0000391	Pa×s	844.91	Joback Calculated Property
η	0.0000295	Pa×s	908.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to Myristin, 2,3-diaceto-1-.

Sources

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

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