HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Deoxy-1-(methylamino)-D-galactitol
N-methyl-galactamine · 1-Deoxy-1-(methylamino)-D-galactitol · D-Galactitol, 1-deoxy-1-(methylamino)- · 1-DEOXY-1-(METHYLAMINO)-D-GALACTITOL 9&

Identifiers & Physical Properties
| CAS No. | 7115-46-0 |
|---|---|
| Molecular formula | C7H17NO5 |
| Average molar mass | 195.21 g/mol |
| Monoisotopic mass | 195.11067264 g/mol |
| SMILES | CNC[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO |
| InChIKey | MBBZMMPHUWSWHV-WNJXEPBRSA-N |
| PubChem CID | 12598090 |
| DTXSID | DTXSID80503903 |
Chemical & Physical Properties
| XLogP | -2.8 |
|---|---|
| Topological polar surface area | 113 |
| Hydrogen bond donors | 6 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 6 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 134 |
| Melting point | 133-136 °C(lit.) |
| Boiling point | 490.4±45.0 °C(Predicted) |
| Density | 1.375±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 13.47±0.20(Predicted) |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P261-P301+P312-P302+P352-P304+P340-P305+P351+P338 |
| Water hazard class (WGK) | 3 |
Safety & Regulations
| Water hazard class (WGK) | 3 |
|---|---|
| Signal word | Warning |
| GHS pictogram | GHS07 |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P261-P301+P312-P302+P352-P304+P340-P305+P351+P338 |
Applications & Uses
Uses
D-(-)-N-Methylgalactamine is used as a starting material for the preparation of sulfoximine-nicotine derivatives that are kinase inhibitors useful in the treatment of proliferative diseases as well as novel tricyclic benzodiazepine carboxamides that are tocolytic oxytocin receptor antagonists.