Chemical Properties of Methyl dihydromalvalate

InChI

InChI=1S/C19H36O2/c1-3-4-5-6-7-10-13-17-16-18(17)14-11-8-9-12-15-19(20)21-2/h17-18H,3-16H2,1-2H3

InChI Key

LYLDBNFUPQGLCE-UHFFFAOYSA-N

Formula

C19H36O2

SMILES

CCCCCCCCC1CC1CCCCCCC(=O)OC

Molecular Weight¹

296.49

• 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°	-71.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-627.83	kJ/mol	Joback Calculated Property
ΔfusH°	46.96	kJ/mol	Joback Calculated Property
ΔvapH°	66.65	kJ/mol	Joback Calculated Property
log10WS	-6.05		Crippen Calculated Property
logPoct/wat	5.887		Crippen Calculated Property
McVol	275.150	ml/mol	McGowan Calculated Property
Pc	1189.88	kPa	Joback Calculated Property
Inp	[2045.00; 2045.00]
Inp	2045.00		NIST
Inp	2045.00		NIST
Tboil	712.48	K	Joback Calculated Property
Tc	887.77	K	Joback Calculated Property
Tfus	389.75	K	Joback Calculated Property
Vc	1.079	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[836.52; 941.40]	J/mol×K	[712.48; 887.77]
Cp,gas	836.52	J/mol×K	712.48	Joback Calculated Property
Cp,gas	856.24	J/mol×K	741.70	Joback Calculated Property
Cp,gas	875.02	J/mol×K	770.91	Joback Calculated Property
Cp,gas	892.89	J/mol×K	800.13	Joback Calculated Property
Cp,gas	909.89	J/mol×K	829.34	Joback Calculated Property
Cp,gas	926.05	J/mol×K	858.56	Joback Calculated Property
Cp,gas	941.40	J/mol×K	887.77	Joback Calculated Property
η	[0.0002816; 0.0020409]	Pa×s	[389.75; 712.48]
η	0.0020409	Pa×s	389.75	Joback Calculated Property
η	0.0012010	Pa×s	443.54	Joback Calculated Property
η	0.0007926	Pa×s	497.33	Joback Calculated Property
η	0.0005673	Pa×s	551.12	Joback Calculated Property
η	0.0004309	Pa×s	604.90	Joback Calculated Property
η	0.0003424	Pa×s	658.69	Joback Calculated Property
η	0.0002816	Pa×s	712.48	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methyl dihydromalvalate.

Sources

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

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