Basic information
- Standard SMILES
CCCCOC(Cn1cncn1)c1ccc(Cl)cc1- InChIKey
LDNITYJIUZPPDS-UHFFFAOYSA-N- Molecular formula
- C14H18ClN3O
- Average molar mass
- 279.76 g/mol
Names & identifiers
- Preferred name
- 1-p-Chlorophenyl-1-n-butoxy-2-(1,2,4-triazol-1-yl)ethane
- IUPAC
- 1-[2-butoxy-2-(4-chlorophenyl)ethyl]-1,2,4-triazole
Names & synonyms
SCHEMBL11194566LDNITYJIUZPPDS-UHFFFAOYSA-N1-p-chlorophenyl-1-n-butoxy-2-(1,2,4-triazol-1-yl)ethane1-p-chlorophenyl-1-n-butyloxy-2-(1,2,4-triazol-1-yl)ethane
Database identifiers
- PubChem CID
- 13655424
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 247
Related reactions
2 records
Compound notes
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