Chemical Properties of Acetic acid 3-acetoxy-2-acetoxymethyl-5-(acetyl-methyl-amino)-6-methoxy-tetrahydro-pyran-4-yl ester

Acetic acid 3-acetoxy-2-acetoxymethyl-5-(acetyl-methyl-amino)-6-methoxy-tetrahydro-pyran-4-yl ester

InChI
InChI=1S/C16H25NO9/c1-8(18)17(5)13-15(25-11(4)21)14(24-10(3)20)12(7-23-9(2)19)26-16(13)22-6/h12-16H,7H2,1-6H3
InChI Key
YHVKYAZUIGOUHQ-UHFFFAOYSA-N
Formula
C16H25NO9
SMILES
COC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C1N(C)C(C)=O
Molecular Weight1
375.37
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 60.21 kJ/mol Joback Calculated Property
logPoct/wat -0.369 Crippen Calculated Property
McVol 271.050 ml/mol McGowan Calculated Property
Inp 2197.34 NIST
Tfus 346.90 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [897.10; 956.96] J/mol×K [856.89; 1060.11] Show Hide
Cp,gas 897.10 J/mol×K 856.89 Joback Calculated Property
Cp,gas 911.42 J/mol×K 890.76 Joback Calculated Property
Cp,gas 924.05 J/mol×K 924.63 Joback Calculated Property
Cp,gas 934.94 J/mol×K 958.50 Joback Calculated Property
Cp,gas 944.08 J/mol×K 992.37 Joback Calculated Property
Cp,gas 951.43 J/mol×K 1026.24 Joback Calculated Property
Cp,gas 956.96 J/mol×K 1060.11 Joback Calculated Property

Similar Compounds

Acetic acid 2-acetoxymethyl-5-(acetyl-methyl-amino)-3,6-dimethoxy-tetrahydro-pyran-4-yl ester. Methyl 4,6-di-O-acetyl-2-deoxy-3-O-methyl-2-(N-methylacetamido)-«alpha»-D-glucopyranoside. Acetic acid 3-acetoxy-5-(acetyl-methyl-amino)-6-methoxy-2-methoxymethyl-tetrahydro-pyran-4-yl ester. Acetic acid 5-(acetyl-methyl-amino) -3,4,6-trimethoxy-tetrahydro-pyran- 2-ylmethyl ester. Acetic acid 5-(acetyl-methyl-amino) -4,6-dimethoxy-2-methoxymethyl-tetrahydro-pyran-3-yl ester. Acetic acid 3-(acetyl-methyl-amino) -2,5-dimethoxy-6-methoxymethyl-tetrahydro-pyran-4-yl ester. N-Methyl 2-deoxy-3 4,6-tri-O-methyl-2-(N-ethylacetamido) -«beta» - D- galactopyranoside. Methyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-ol-D-mannopyranoside. N-Methyl-N-(2,4,5-trimethoxy-6-methoxymethyl-tetrahydro-pyran-3-yl)-acetamide. (S)-2-Butyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-[3-o-glucopyranoside. (R)-2-Butyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-[3-o-glucopyranoside. Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«beta»-D-galactopyranoside. Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«alpha»-D-glucopyranoside. Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«alpha»-D-mannopyranoside. Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«beta»-D-glucopyranoside.

Find more compounds similar to Acetic acid 3-acetoxy-2-acetoxymethyl-5-(acetyl-methyl-amino)-6-methoxy-tetrahydro-pyran-4-yl ester.

Sources

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.
These property values are available through the Cheméo API. A free account gives you an access key.