Basic information
- CAS
70132-65-9- Standard SMILES
CN(C)CC(O)Cn1ccnc1[N+](=O)[O-]- InChIKey
VGNDSOPZUVWPGK-UHFFFAOYSA-N- Molecular formula
- C8H14N4O3
- Average molar mass
- 214.22 g/mol
- Monoisotopic mass
- 214.10659032
Names & identifiers
- Preferred name
- 1-(Dimethylamino)-3-(2-nitroimidazol-1-yl)propan-2-ol
- IUPAC
- 1-(dimethylamino)-3-(2-nitroimidazol-1-yl)propan-2-ol
Names & synonyms
70132-65-91-(dimethylamino)-3-(2-nitroimidazol-1-yl)propan-2-olNSC301468SCHEMBL11358546DTXSID90316263NSC-3014681-(Dimethylamino)-3-(2-nitro-1H-imidazol-1-yl)propan-2-ol
Database identifiers
- CAS
70132-65-9- PubChem CID
- 327237
- DTXSID
DTXSID90316263
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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