Chemical Properties of 1-(Nonanoyloxy)-3-(octanoyloxy)propan-2-yl decanoate

InChI

InChI=1S/C30H56O6/c1-4-7-10-13-15-18-21-24-30(33)36-27(25-34-28(31)22-19-16-12-9-6-3)26-35-29(32)23-20-17-14-11-8-5-2/h27H,4-26H2,1-3H3

InChI Key

PKMKZQZKAMXXQN-UHFFFAOYSA-N

Formula

C30H56O6

SMILES

CCCCCCCCCC(=O)OC(COC(=O)CCCCCCC)COC(=O)CCCCCCCC

Molecular Weight¹

512.76

• 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°	-502.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-1402.21	kJ/mol	Joback Calculated Property
ΔfusH°	78.29	kJ/mol	Joback Calculated Property
ΔvapH°	109.45	kJ/mol	Joback Calculated Property
log10WS	-9.08		Crippen Calculated Property
logPoct/wat	8.236		Crippen Calculated Property
McVol	455.880	ml/mol	McGowan Calculated Property
Pc	640.27	kPa	Joback Calculated Property
Inp	[3221.50; 3221.50]
Inp	3221.50		NIST
Inp	3221.50		NIST
Tboil	1114.23	K	Joback Calculated Property
Tc	1417.46	K	Joback Calculated Property
Tfus	629.34	K	Joback Calculated Property
Vc	1.782	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1649.32; 1720.41]	J/mol×K	[1114.23; 1417.46]
Cp,gas	1649.32	J/mol×K	1114.23	Joback Calculated Property
Cp,gas	1669.52	J/mol×K	1164.77	Joback Calculated Property
Cp,gas	1686.22	J/mol×K	1215.31	Joback Calculated Property
Cp,gas	1699.54	J/mol×K	1265.84	Joback Calculated Property
Cp,gas	1709.60	J/mol×K	1316.38	Joback Calculated Property
Cp,gas	1716.52	J/mol×K	1366.92	Joback Calculated Property
Cp,gas	1720.41	J/mol×K	1417.46	Joback Calculated Property
η	[0.0000069; 0.0001337]	Pa×s	[629.34; 1114.23]
η	0.0001337	Pa×s	629.34	Joback Calculated Property
η	0.0000617	Pa×s	710.15	Joback Calculated Property
η	0.0000333	Pa×s	790.97	Joback Calculated Property
η	0.0000202	Pa×s	871.78	Joback Calculated Property
η	0.0000133	Pa×s	952.60	Joback Calculated Property
η	0.0000094	Pa×s	1033.41	Joback Calculated Property
η	0.0000069	Pa×s	1114.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-(Nonanoyloxy)-3-(octanoyloxy)propan-2-yl decanoate.

Sources

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

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