Basic information
- CAS
177944-39-7- Standard SMILES
CC(O)(CO)CN(O)CC(C)(O)CO- InChIKey
GIJYZWJXXKQHME-UHFFFAOYSA-N- Molecular formula
- C8H19NO5
- Average molar mass
- 209.24 g/mol
- Monoisotopic mass
- 209.12632271
Names & identifiers
- Preferred name
- 2,2'-[(Hydroxyazanediyl)bis(methylene)]di(propane-1,2-diol)
- IUPAC
- 3-[(2,3-dihydroxy-2-methylpropyl)-hydroxyamino]-2-methylpropane-1,2-diol
Names & synonyms
177944-39-7SCHEMBL3629104DTXSID106215432,2'-[(Hydroxyazanediyl)bis(methylene)]di(propane-1,2-diol)
Database identifiers
- CAS
177944-39-7- PubChem CID
- 22016308
- DTXSID
DTXSID10621543
Properties
Computed structural properties
- XLogP
- -2.5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 161
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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