Basic information
- Standard SMILES
CC(C)(C)[N+]([O-])=Cc1ccc(Br)cc1- InChIKey
IJVYGXONIVPBHE-UHFFFAOYSA-N- Molecular formula
- C11H14BrNO
- Average molar mass
- 256.14 g/mol
- Monoisotopic mass
- 255.02588
Names & identifiers
- Preferred name
- N-tert-Butyl-alpha-(4-bromophenyl)nitrone
- IUPAC
- 1-(4-bromophenyl)-N-tert-butylmethanimine oxide
Names & synonyms
SCHEMBL6935466IJVYGXONIVPBHE-UHFFFAOYSA-NN-tert-Butyl-alpha-(4-bromophenyl)nitrone
Database identifiers
- PubChem CID
- 73166239
- DTXSID
DTXSID80876422
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 28.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
1 records
Linked notes
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