Basic information
- CAS
368426-76-0- Standard SMILES
N#Cc1ccc(CN=[N+]=[N-])cc1F- InChIKey
BNAMFNNZROYBTM-UHFFFAOYSA-N- Molecular formula
- C8H5FN4
- Average molar mass
- 176.15 g/mol
- Monoisotopic mass
- 176.04982438
Names & identifiers
- Preferred name
- 4-Azidomethyl-2-fluorobenzonitrile
- IUPAC
- 4-(azidomethyl)-2-fluorobenzonitrile
Names & synonyms
4-Azidomethyl-2-fluorobenzonitrile368426-76-0SCHEMBL27547021BNAMFNNZROYBTM-UHFFFAOYSA-NDTXSID1012898344-(azidomethyl)-2-fluorobenzonitrile
Database identifiers
- CAS
368426-76-0- PubChem CID
- 21904643
- DTXSID
DTXSID101289834
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 263
Related reactions
8 records
Compound notes
Loading…