Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
Basic information
- CAS
58747-66-3- Standard SMILES
COC(=O)c1cn2cc(Cl)cc(Cl)c2c1C(=O)OC- InChIKey
NWPZGDJERLZUHZ-UHFFFAOYSA-N- Molecular formula
- C12H9Cl2NO4
- Average molar mass
- 302.11 g/mol
- Monoisotopic mass
- 300.9908632
Names & identifiers
- Preferred name
- Dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
- IUPAC
- dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate
Names & synonyms
dimethyl 6,8-dichloroindolizine-1,2-dicarboxylate58747-66-3NSC234198DTXSID70310906AKOS027427262NSC-234198
Database identifiers
- CAS
58747-66-3- PubChem CID
- 314713
- DTXSID
DTXSID70310906
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 379
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Related reactions
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Compound notes
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