(2S,3S,4S,5R)-4-fluoro-3-hydroxy-5-(hydroxymethyl)oxolane-2-carbonitrile
Basic information
- CAS
122558-17-2- Standard SMILES
N#C[C@@H]1O[C@H](CO)[C@@H](F)[C@H]1O- InChIKey
HATFRYLSBILYHD-KCDKBNATSA-N- Molecular formula
- C6H8FNO3
- Average molar mass
- 161.13 g/mol
Names & identifiers
- Preferred name
- (2S,3S,4S,5R)-4-fluoro-3-hydroxy-5-(hydroxymethyl)oxolane-2-carbonitrile
- IUPAC
- (2S,3S,4S,5R)-4-fluoro-3-hydroxy-5-(hydroxymethyl)oxolane-2-carbonitrile
- English name
- D-Allononitrile, 2,5-anhydro-4-deoxy-4-fluoro- (9CI)
- Molecular formula
- C6H8FNO3
- Molecular weight
- 161.1310232
Names & synonyms
D-Allononitrile, 2,5-anhydro-4-deoxy-4-fluoro- (9CI)
Database identifiers
- CAS
122558-17-2
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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