Chemical Properties of Glycerol, 2,3-dimethyl, 1-heptadecanoate

InChI

InChI=1S/C22H44O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(23)26-20-21(25-3)19-24-2/h21H,4-20H2,1-3H3

InChI Key

LAVHQUSMQCEMCR-UHFFFAOYSA-N

Formula

C22H44O4

SMILES

CCCCCCCCCCCCCCCCC(=O)OCC(COC)OC

Molecular Weight¹

372.58

• 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

Property	Value	Unit	Source
ΔfH°gas	-1035.29	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	55.96	kJ/mol	Joback Calculated Property
ΔvapH°	114.34	kJ/mol	Relay (1.0) Calculated Property
IE	9.55	eV	Relay (1.0) Calculated Property
log10WS	-5.71		Relay (1.0) Calculated Property
logPoct/wat	6.062		Crippen Calculated Property
McVol	340.020	ml/mol	McGowan Calculated Property
Pc	890.54	kPa	Joback Calculated Property
Inp	[2371.00; 2371.00]
Inp	2371.00		NIST
Inp	2371.00		NIST
Tboil	630.48	K	Relay (1.0) Calculated Property
Tc	809.05	K	Relay (1.0) Calculated Property
Tfus	293.31	K	Relay (1.0) Calculated Property

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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1088.93; 1193.93]	J/mol×K	[805.58; 986.78]
Cp,gas	1088.93	J/mol×K	805.58	Joback Calculated Property
Cp,gas	1109.35	J/mol×K	835.78	Joback Calculated Property
Cp,gas	1128.58	J/mol×K	865.98	Joback Calculated Property
Cp,gas	1146.64	J/mol×K	896.18	Joback Calculated Property
Cp,gas	1163.54	J/mol×K	926.38	Joback Calculated Property
Cp,gas	1179.30	J/mol×K	956.58	Joback Calculated Property
Cp,gas	1193.93	J/mol×K	986.78	Joback Calculated Property
η	[0.0000254; 0.0009925]	Pa×s	[409.49; 805.58]
η	0.0009925	Pa×s	409.49	Joback Calculated Property
η	0.0003525	Pa×s	475.50	Joback Calculated Property
η	0.0001611	Pa×s	541.52	Joback Calculated Property
η	0.0000873	Pa×s	607.53	Joback Calculated Property
η	0.0000533	Pa×s	673.55	Joback Calculated Property
η	0.0000356	Pa×s	739.56	Joback Calculated Property
η	0.0000254	Pa×s	805.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycerol, 2,3-dimethyl, 1-heptadecanoate.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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