Basic information
- Standard SMILES
CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@@H](OC(=N)C(Cl)(Cl)Cl)O[C@H](CCl)[C@H]1OC(C)=O- InChIKey
AENFDCLPGGWJNW-RMPHRYRLSA-N- Molecular formula
- C14H17Cl4NO8
- Average molar mass
- 469.1 g/mol
Names & identifiers
- Preferred name
- O-(2,3,4-tri-O-acetyl-6-chloro-6-deoxy-alpha-D-glucopyranosyl) trichloroacetimidate
- IUPAC
- [(2S,3S,4S,5R,6R)-4,5-diacetyloxy-2-(chloromethyl)-6-(2,2,2-trichloroethanimidoyl)oxyoxan-3-yl] acetate
Names & synonyms
SCHEMBL8331643AENFDCLPGGWJNW-RMPHRYRLSA-NO-(2,3,4-tri-O-acetyl-6-chloro-6-deoxy-alpha-D-glucopyranosyl) trichloroacetimidate
Database identifiers
- PubChem CID
- 53638677
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 596
Related reactions
1 records
Compound notes
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