Basic information
- CAS
14917-59-0- Standard SMILES
[N-]=[N+]=NC(=O)c1ccc(Br)cc1- InChIKey
YYBPTEUTLXWMRY-UHFFFAOYSA-N- Molecular formula
- C7H4BrN3O
- Average molar mass
- 226.03 g/mol
- Monoisotopic mass
- 224.95377
Names & identifiers
- Preferred name
- 4-Bromobenzoyl azide
- IUPAC
- 4-bromobenzoyl azide
Names & synonyms
4-bromobenzoyl azide4-Brombenzoylazide14917-59-0SCHEMBL28459756DTXSID60345343YYBPTEUTLXWMRY-UHFFFAOYSA-NAKOS009452028
Database identifiers
- CAS
14917-59-0- PubChem CID
- 603876
- DTXSID
DTXSID60345343- Nikkaji
- J472.376G
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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