Basic information
- CAS
921592-88-3- Standard SMILES
O=[N+]([O-])c1ccc(N2CC[C@@H](O)C2)cn1- InChIKey
ZUHDWUYCYKDTAC-MRVPVSSYSA-N- Molecular formula
- C9H11N3O3
- Average molar mass
- 209.2 g/mol
- Monoisotopic mass
- 209.08004122
Names & identifiers
- Preferred name
- (3R)-1-(6-nitropyridin-3-yl)pyrrolidin-3-ol
- IUPAC
- (3R)-1-(6-nitro-3-pyridinyl)pyrrolidin-3-ol
Names & synonyms
921592-88-3(R)-1-(6-Nitropyridin-3-yl)pyrrolidin-3-ol(3R)-1-(6-nitropyridin-3-yl)pyrrolidin-3-olSCHEMBL4875099DTXSID50740040ZUHDWUYCYKDTAC-MRVPVSSYSA-N
Database identifiers
- CAS
921592-88-3- PubChem CID
- 69225331
- DTXSID
DTXSID50740040
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 82.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 243
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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