5-Chloro-1-propoxybenzotriazole
Basic information
- CAS
68229-96-9- Standard SMILES
CCCOn1nnc2cc(Cl)ccc21- InChIKey
TYPGSMRPHOSTCZ-UHFFFAOYSA-N- Molecular formula
- C9H10ClN3O
- Average molar mass
- 211.65 g/mol
- Monoisotopic mass
- 211.0512396
Names & identifiers
- Preferred name
- 5-Chloro-1-propoxybenzotriazole
- IUPAC
- 5-chloro-1-propoxybenzotriazole
Names & synonyms
68229-96-95-chloro-1-propoxybenzotriazoleNSC293932DTXSID30315316NSC-2939325-Chloro-1-propoxy-1H-1,2,3-benzotriazole
Database identifiers
- CAS
68229-96-9- PubChem CID
- 325360
- DTXSID
DTXSID30315316
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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