Basic information
- CAS
127692-17-5- Standard SMILES
O=[N+]([O-])c1cn2c(n1)OC(CBr)C2- InChIKey
PDWWZOLSINWCMB-UHFFFAOYSA-N- Molecular formula
- C6H6BrN3O3
- Average molar mass
- 248.03 g/mol
- Monoisotopic mass
- 246.95925
Names & identifiers
- Preferred name
- Imidazo(2,1-b)oxazole, 2-(bromomethyl)-2,3-dihydro-6-nitro-
- IUPAC
- 2-(bromomethyl)-6-nitro-2,3-dihydroimidazo[2,1-b][1,3]oxazole
Names & synonyms
127692-17-5Imidazo(2,1-b)oxazole, 2-(bromomethyl)-2,3-dihydro-6-nitro-Imidazo[2,1-b]oxazole, 2-(bromomethyl)-2,3-dihydro-6-nitro-DTXSID609259472-(bromomethyl)-6-nitro-2,3-dihydroimidazo[2,1-b][1,3]oxazole2-(bromomethyl)-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole
Database identifiers
- CAS
127692-17-5- PubChem CID
- 460735
- DTXSID
DTXSID60925947
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 222
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…