Basic information
- Standard SMILES
O=[N+]([O-])c1nccn1C[C@H](O)CN1CC1- InChIKey
OEWYWFJWBZNJJG-SSDOTTSWSA-N- Molecular formula
- C8H12N4O3
- Average molar mass
- 212.21 g/mol
- Monoisotopic mass
- 212.09094026
Names & identifiers
- Preferred name
- (R)-(-)-alpha-(1-Aziridinylmethyl)-2-nitro-1H-imidazole-1-ethanol
- IUPAC
- (2R)-1-(aziridin-1-yl)-3-(2-nitroimidazol-1-yl)propan-2-ol
Names & synonyms
(R)-(-)-alpha-(1-Aziridinylmethyl)-2-nitro-1H-imidazole-1-ethanolSCHEMBL8855534OEWYWFJWBZNJJG-SSDOTTSWSA-N(2R)-1-(aziridin-1-yl)-3-(2-nitroimidazol-1-yl)propan-2-ol
Database identifiers
- PubChem CID
- 10242276
- Nikkaji
- J826.432E
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Related reactions
6 records
Compound notes
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