Basic information
- Standard SMILES
Cc1cccc(-n2nc3ccccc3n2)c1O- InChIKey
RPQXCWCOHAKYBH-UHFFFAOYSA-N- Molecular formula
- C13H11N3O
- Average molar mass
- 225.25 g/mol
- Monoisotopic mass
- 225.09021198
Names & identifiers
- Preferred name
- 2-(2'-Hydroxy-methylphenyl) benzotriazole
- IUPAC
- 2-(benzotriazol-2-yl)-6-methylphenol
Names & synonyms
SCHEMBL5423166SCHEMBL8374221SCHEMBL30778372RPQXCWCOHAKYBH-UHFFFAOYSA-N2-(2'-hydroxy-methylphenyl) benzotriazole
Database identifiers
- PubChem CID
- 13580809
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Related reactions
1 records
Compound notes
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