Basic information
- CAS
70659-91-5- Standard SMILES
[N-]=[N+]=NCCCOc1ccccc1- InChIKey
LRUPGIBPPUVYCS-UHFFFAOYSA-N- Molecular formula
- C9H11N3O
- Average molar mass
- 177.2 g/mol
- Monoisotopic mass
- 177.09021198
Names & identifiers
- Preferred name
- (3-Azidopropoxy)benzene
- IUPAC
- 3-azidopropoxybenzene
Names & synonyms
(3-azidopropoxy)benzene70659-91-5SCHEMBL22764566SCHEMBL27600151DTXSID901313782AKOS010632117F1901-3130
Database identifiers
- CAS
70659-91-5- PubChem CID
- 61374388
- DTXSID
DTXSID901313782- Nikkaji
- J2.966.521D
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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