2-(Phenylmethoxymethyl)-5-pyrrol-1-yloxolane-3,4-diol
Basic information
- CAS
80541-20-4- Standard SMILES
OC1C(COCc2ccccc2)OC(n2cccc2)C1O- InChIKey
LXAAFLIJCYDALT-UHFFFAOYSA-N- Molecular formula
- C16H19NO4
- Average molar mass
- 289.33 g/mol
- Monoisotopic mass
- 289.13140809
Names & identifiers
- Preferred name
- 2-(Phenylmethoxymethyl)-5-pyrrol-1-yloxolane-3,4-diol
- IUPAC
- 2-(phenylmethoxymethyl)-5-pyrrol-1-yloxolane-3,4-diol
Names & synonyms
NSC35877480541-20-4DTXSID30320389NSC-3587741-(5-O-Benzylpentofuranosyl)-1H-pyrrole
Database identifiers
- CAS
80541-20-4- PubChem CID
- 338068
- DTXSID
DTXSID30320389
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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