Basic information
- CAS
42852-95-9- Standard SMILES
CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1O- InChIKey
OBSLWIKITOYASJ-AZEWMMITSA-N- Molecular formula
- C7H15NO5
- Average molar mass
- 193.2 g/mol
- Monoisotopic mass
- 193.09502258
Names & identifiers
- Preferred name
- N-Methyl-alpha-L-glucosamine
- IUPAC
- (2R,3S,4S,5R,6S)-6-(hydroxymethyl)-3-(methylamino)oxane-2,4,5-triol
- English name
- N-METHYL-D-GLUCOSAMINE
- Molecular formula
- C7H15NO5
- Molecular weight
- 193.2
Names & synonyms
42852-95-9N-Methyl-alpha-L-glucosamine095FC2WW65alpha-L-Glucopyranose, 2-deoxy-2-(methylamino)-GlyTouCan:G05400LLRefChem:1048452G05400LLn-methyl-l-glucosaminea-L-Glucopyranose,2-deoxy-2-(methylamino)-UNII-095FC2WW65N-Methyl-alpha-L-glucosamine [MI]N-METHYL-.ALPHA.-L-GLUCOSAMINE
Show more names
N-Methyl-a-L-glucosamineα-L-Glucopyranose, 2-deoxy-2-(methylamino)-
MM1571002- Deoxy- 2- (methylamino) - L- glucoseN-METHYL-.ALPHA.-L-GLUCOSAMINE [MI]Q27236460.ALPHA.-L-GLUCOPYRANOSE, 2-DEOXY-2-(METHYLAMINO)-
Database identifiers
- CAS
42852-95-9- PubChem CID
- 90479215
- UNII
- 095FC2WW65
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- alpha
- 25 · D25 -62° (c = 1 in methanol)
- Boiling point
- 329.41 °C · 329.41°C (rough estimate)
- Density
- 1.3109 · 1.3109 (rough estimate)
- refractive index
- 1.45 · 1.4500 (estimate)
- pka
- 12.36 · 12.36±0.70(Predicted)
- FDA UNII
- 95 FC2WW65 · 095FC2WW65
Chemistry & industry
Suppliers2 total
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Yick-Vic Chemicals & Pharmaceuticals (HK) Ltd(852)2541 2772
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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