Chemical Properties of N-Methyl-N-(2,4,5-trimethoxy-6-methoxymethyl-tetrahydro-pyran-3-yl)-acetamide

InChI

InChI=1S/C13H25NO6/c1-8(15)14(2)10-12(18-5)11(17-4)9(7-16-3)20-13(10)19-6/h9-13H,7H2,1-6H3

InChI Key

LLBFFWSIFJDSHK-UHFFFAOYSA-N

Formula

C13H25NO6

SMILES

COCC1OC(OC)C(N(C)C(C)=O)C(OC)C1OC

Molecular Weight¹

291.34

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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°	-472.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-1044.62	kJ/mol	Joback Calculated Property
ΔfusH°	42.90	kJ/mol	Joback Calculated Property
ΔvapH°	66.66	kJ/mol	Joback Calculated Property
log10WS	5.01e-03		Crippen Calculated Property
logPoct/wat	-0.119		Crippen Calculated Property
McVol	224.070	ml/mol	McGowan Calculated Property
Pc	1723.16	kPa	Joback Calculated Property
Inp	[1824.63; 1824.63]
Inp	1824.63		NIST
Inp	1824.63		NIST
Tboil	680.65	K	Joback Calculated Property
Tc	870.20	K	Joback Calculated Property
Tfus	424.58	K	Joback Calculated Property
Vc	0.809	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[677.56; 777.86]	J/mol×K	[680.65; 870.20]
Cp,gas	677.56	J/mol×K	680.65	Joback Calculated Property
Cp,gas	696.96	J/mol×K	712.24	Joback Calculated Property
Cp,gas	715.33	J/mol×K	743.83	Joback Calculated Property
Cp,gas	732.64	J/mol×K	775.43	Joback Calculated Property
Cp,gas	748.85	J/mol×K	807.02	Joback Calculated Property
Cp,gas	763.93	J/mol×K	838.61	Joback Calculated Property
Cp,gas	777.86	J/mol×K	870.20	Joback Calculated Property

Similar Compounds

Find more compounds similar to N-Methyl-N-(2,4,5-trimethoxy-6-methoxymethyl-tetrahydro-pyran-3-yl)-acetamide.

Sources

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

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