Diethyl (2R,3S)-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate
Basic information
- CAS
67261-38-5- Standard SMILES
CCOC(=O)[C@H]1Oc2ccccc2O[C@H]1C(=O)OCC- InChIKey
IATYLCAIYBFZSI-TXEJJXNPSA-N- Molecular formula
- C14H16O6
- Average molar mass
- 280.27 g/mol
- Monoisotopic mass
- 280.09468823
Names & identifiers
- Preferred name
- Diethyl (2R,3S)-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate
- IUPAC
- diethyl (2R,3S)-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate
Names & synonyms
67261-38-5DTXSID60496980Diethyl (2R,3S)-2,3-dihydro-1,4-benzodioxine-2,3-dicarboxylate
Database identifiers
- CAS
67261-38-5- PubChem CID
- 12410568
- DTXSID
DTXSID60496980
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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