Basic information
- Standard SMILES
OCCCC#Cc1cc(Cl)ccc1Cl- InChIKey
XXKAOSQHKZFJNA-UHFFFAOYSA-N- Molecular formula
- C11H10Cl2O
- Average molar mass
- 229.1 g/mol
Names & identifiers
- Preferred name
- 5-(2,5-Dichlorophenyl)pent-4-yn-1-ol
- IUPAC
- 5-(2,5-dichlorophenyl)pent-4-yn-1-ol
Names & synonyms
5-(2,5-dichlorophenyl)pent-4-yn-1-olSCHEMBL6297687XXKAOSQHKZFJNA-UHFFFAOYSA-N5-(2,5dichlorophenyl)-pent-4-yn-1-ol5-(2,5-dichloro-phenyl)pent-4-yn-1-ol5-(2,5-dichlorophenyl)-pent-4-yn-1-ol
Database identifiers
- PubChem CID
- 22320759
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 228
Related reactions
11 records
Compound notes
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