Chemical Properties of N-Acetyl-D-glucosamine, aldononitrile, tetraacetate

N-Acetyl-D-glucosamine, aldononitrile, tetraacetate

InChI
InChI=1S/C16H22N2O9/c1-8(19)18-13(6-17)15(26-11(4)22)16(27-12(5)23)14(25-10(3)21)7-24-9(2)20/h13-16H,7H2,1-5H3,(H,18,19)
InChI Key
MMTPGHDGDMHPRG-UHFFFAOYSA-N
Formula
C16H22N2O9
SMILES
CC(=O)NC(C#N)C(OC(C)=O)C(OC(C)=O)C(COC(C)=O)OC(C)=O
Molecular Weight1
386.36
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Physical Properties

Property Value Unit Source
ΔfusH° 42.46 kJ/mol Joback Calculated Property
logPoct/wat -0.627 Crippen Calculated Property
McVol 278.990 ml/mol McGowan Calculated Property
Inp [2080.50; 2080.50]   Show Hide
Inp 2080.50 NIST
Inp 2080.50 NIST
Tfus 378.57 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 [893.09; 902.76] J/mol×K [1075.00; 1316.23] Show Hide
Cp,gas 893.88 J/mol×K 1075.00 Joback Calculated Property
Cp,gas 898.85 J/mol×K 1115.20 Joback Calculated Property
Cp,gas 901.82 J/mol×K 1155.41 Joback Calculated Property
Cp,gas 902.76 J/mol×K 1195.61 Joback Calculated Property
Cp,gas 901.64 J/mol×K 1235.82 Joback Calculated Property
Cp,gas 898.43 J/mol×K 1276.02 Joback Calculated Property
Cp,gas 893.09 J/mol×K 1316.23 Joback Calculated Property

Similar Compounds

[2H]Glucitolamine hexaacetate. N-Acetyl-D-glucosamine, tetrakis(trifluoroacetate), methyloxime (syn). N-Acetyl-D-glucosamine, tetrakis(trifluoroacetate), methyloxime (anti). N-Acetyl-D-galactosaminitol, pentakis(trifluoroacetate). Acetic acid 3-acetoxy-2-acetoxymethyl-5-(acetyl-methyl-amino)-6-methoxy-tetrahydro-pyran-4-yl ester. .beta.-Mannosyl-(1-4)-N-acetylglucosamine, permethyl. Methyl 4,6-di-O-acetyl-2-deoxy-3-O-methyl-2-(N-methylacetamido)-«alpha»-D-glucopyranoside. Acetic acid 2-acetoxymethyl-5-(acetyl-methyl-amino)-3,6-dimethoxy-tetrahydro-pyran-4-yl ester. 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 3-(acetyl-methyl-amino) -2,5-dimethoxy-6-methoxymethyl-tetrahydro-pyran-4-yl ester. Acetic acid 5-(acetyl-methyl-amino) -4,6-dimethoxy-2-methoxymethyl-tetrahydro-pyran-3-yl ester. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Naltrexone. 5,6-Dihydrouracil riboside, TMS.

Find more compounds similar to N-Acetyl-D-glucosamine, aldononitrile, tetraacetate.

Sources

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