2-Methyl-3-nitroindolizine
Basic information
- CAS
39203-44-6- Standard SMILES
Cc1cc2ccccn2c1[N+](=O)[O-]- InChIKey
JUAOFANUBWVWJG-UHFFFAOYSA-N- Molecular formula
- C9H8N2O2
- Average molar mass
- 176.17 g/mol
- Monoisotopic mass
- 176.0585775
Names & identifiers
- Preferred name
- 2-Methyl-3-nitroindolizine
- IUPAC
- 2-methyl-3-nitroindolizine
Names & synonyms
2-Methyl-3-nitroindolizine39203-44-6DTXSID70344948RefChem:263279DTXCID00296022JUAOFANUBWVWJG-UHFFFAOYSA-N
Database identifiers
- CAS
39203-44-6- PubChem CID
- 600642
- DTXSID
DTXSID70344948
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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