Basic information
- CAS
25320-92-7- Standard SMILES
CC(C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O- InChIKey
UOEFDXYUEPHESS-ZEBDFXRSSA-N- Molecular formula
- C9H18O6
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.11033829
Names & identifiers
- Preferred name
- isopropyl alpha-D-glucopyranoside
- IUPAC
- (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-yloxyoxane-3,4,5-triol
Names & synonyms
isopropyl alpha-D-glucopyranoside25320-92-7alpha-D-Glucopyranoside, 1-methylethyl-Propan-2-yl hexopyranosideSCHEMBL7085226SCHEMBL13280793DTXSID10948166Propan-2-yl alpha-D-glucopyranoside
Database identifiers
- CAS
25320-92-7- PubChem CID
- 179451
- DTXSID
DTXSID10948166- Nikkaji
- J1.057.975I
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 197
Related reactions
1 records
Compound notes
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