Chemical Properties of Alpha,d-glucopyranoside, 2-acetamido-2-deoxy- (CAS 10036-64-3)

Alpha,d-glucopyranoside, 2-acetamido-2-deoxy-

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InChI
InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)
InChI Key
OVRNDRQMDRJTHS-UHFFFAOYSA-N
Formula
C8H15NO6
SMILES
CC(=O)NC1C(O)OC(CO)C(O)C1O
Molecular Weight1
221.21
CAS
10036-64-3
Other Names
  • Alpha,d-glucopyranoside, 2-acetamido-2-deoxy-,
  • Glucopyranose, 2-acetamido-2-deoxy-, «alpha»-D-
  • N-Acetyl-«alpha»-D-glucosamine
  • «alpha»-D-Glucopyranose, 2-(acetylamino)-2-deoxy-
  • «alpha»-D-glucopyranoside, 2-acetamido-2-deoxy-,
Sources

Physical Properties

Property Value Unit Source
Δf -662.84 kJ/mol Joback Calculated Property
Δfgas -1035.52 kJ/mol Joback Calculated Property
Δfus 43.62 kJ/mol Joback Calculated Property
Δvap 117.00 kJ/mol Joback Calculated Property
logPoct/wat -3.08 Crippen Calculated Property
Pc 4577.74 kPa Joback Calculated Property
Tboil 883.02 K Joback Calculated Property
Tc 1081.35 K Joback Calculated Property
Tfus 542.78 K Joback Calculated Property
Vc 0.55 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 537.44 J/mol×K 883.02 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 1
-CH3 1
-OH (alcohol) 4
-CH2- 1
>NH 1
>C=O (nonring) 1
>CH- (ring) 5

Similar Compounds

.beta.-Mannosyl-(1-4)-N-acetylglucosamine, permethyl. 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)-«alpha»-D-glucopyranoside. Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«alpha»-D-galactopyranoside. 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-mannopyranoside. Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«beta»-D-glucopyranoside. Acetic acid 5-(acetyl-methyl-amino) -4,6-dimethoxy-2-methoxymethyl-tetrahydro-pyran-3-yl ester. Methyl 4,6-di-O-acetyl-2-deoxy-3-O-methyl-2-(N-methylacetamido)-«alpha»-D-glucopyranoside. Acetic acid 3-(acetyl-methyl-amino) -2,5-dimethoxy-6-methoxymethyl-tetrahydro-pyran-4-yl ester. Acetic acid 2-acetoxymethyl-5-(acetyl-methyl-amino)-3,6-dimethoxy-tetrahydro-pyran-4-yl ester.

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