Basic information
- CAS
60454-99-1- Standard SMILES
CCCCOn1nnc2ccccc21- InChIKey
KRZGXODBKDWXNU-UHFFFAOYSA-N- Molecular formula
- C10H13N3O
- Average molar mass
- 191.23 g/mol
- Monoisotopic mass
- 191.10586205
Names & identifiers
- Preferred name
- 1-Butoxybenzotriazole
- IUPAC
- 1-butoxybenzotriazole
Names & synonyms
60454-99-11-butoxybenzotriazoleNSC286156SCHEMBL4080308DTXSID003145781-Butoxy-1H-1,2,3-benzotriazoleNSC-286156
Database identifiers
- CAS
60454-99-1- PubChem CID
- 323686
- DTXSID
DTXSID00314578
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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