Basic information
- CAS
21994-40-1- Standard SMILES
N#CCCCN=[N+]=[N-]- InChIKey
SBIAREQXQLOOAR-UHFFFAOYSA-N- Molecular formula
- C4H6N4
- Average molar mass
- 110.12 g/mol
- Monoisotopic mass
- 110.05924621
Names & identifiers
- Preferred name
- 4-Azidobutanenitrile
- IUPAC
- 4-azidobutanenitrile
Names & synonyms
4-azidobutanenitrile21994-40-1DTXSID60398334RefChem:290215DTXCID50349193Butanenitrile, 4-azido-SCHEMBL15229267NSC137895AKOS010633574NSC-137895DS-010568EN300-111967
Database identifiers
- CAS
21994-40-1- PubChem CID
- 3975474
- DTXSID
DTXSID60398334- Nikkaji
- J832.399B
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 135
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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