Basic information
- Standard SMILES
OCC#Cc1ccc(-c2ccc(Cl)cc2)cn1- InChIKey
OQBNGQOVNKTERF-UHFFFAOYSA-N- Molecular formula
- C14H10ClNO
- Average molar mass
- 243.69 g/mol
Names & identifiers
- Preferred name
- 3-[5-(4-Chloro-phenyl)-pyridin-2-yl]-prop-2-yn-1-ol
- IUPAC
- 3-[5-(4-chlorophenyl)-2-pyridinyl]prop-2-yn-1-ol
Names & synonyms
SCHEMBL4518553OQBNGQOVNKTERF-UHFFFAOYSA-N3-[5-(4-chloro-phenyl)-pyridin-2-yl]-prop-2-yn-1-ol
Database identifiers
- PubChem CID
- 69076337
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 298
Related reactions
3 records
Compound notes
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