Basic information
- CAS
2351-14-6- Standard SMILES
NC(CO)C(O)C(O)C(O)CO- InChIKey
FQORWEQXRQVPBZ-UHFFFAOYSA-N- Molecular formula
- C6H15NO5
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.09502258
Names & identifiers
- Preferred name
- 5-Aminohexane-1,2,3,4,6-pentol
- IUPAC
- 5-aminohexane-1,2,3,4,6-pentol
- English name
- 5-aminohexane-1,2,3,4,6-pentol
- Molecular formula
- C6H15NO5
- Molecular weight
- 181.19
Names & synonyms
5-aminohexane-1,2,3,4,6-pentol2351-14-62-Amino-2-deoxyhexitolSCHEMBL3797037DTXSID60313360NSC269409NSC-269409MA137341Glucitol, 2-amino-2-deoxy-
Database identifiers
- CAS
2351-14-6- PubChem CID
- 320736
- DTXSID
DTXSID60313360
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)
Chemistry & industry
Suppliers1 total
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Related reactions
1 records
Compound notes
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