Basic information
- Standard SMILES
N[C@@H](CO)[C@@H](O)[C@@H](O)[C@H](O)CO- InChIKey
FQORWEQXRQVPBZ-KCDKBNATSA-N- Molecular formula
- C6H15NO5
- Average molar mass
- 181.19 g/mol
Overview
RN given refers to (D)-isomer
Names & identifiers
- Preferred name
- 2-Amino-2-deoxygalactitol
- IUPAC
- (2R,3R,4R,5S)-5-aminohexane-1,2,3,4,6-pentol
- English name
- 2-amino-2-deoxygalactitol
- Molecular formula
- C6H15NO5
- Molecular weight
- 181.19
Names & synonyms
2-Amino-2-deoxygalactitol2-Amino-2-deoxy-D-galactitolGalactosaminitol20706-37-0D-Galactitol, 2-amino-2-deoxy-RefChem:85074SCHEMBL2869678SCHEMBL8528304AKOS006295480
Database identifiers
- CAS
20706-37-0- PubChem CID
- 193563
- Nikkaji
- J611.848H
Properties
Computed structural properties
- XLogP
- -3.4
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 123
Physicochemical properties
- Boiling point
- 530.7 · 530.7±50.0 °C(Predicted)
- Density
- 1.506 · 1.506±0.06 g/cm3(Predicted)
- pka
- 11.66 · 11.66±0.45(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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