1-(5-Chloro-2-hydroxyphenyl)-3-pyridin-3-ylpropane-1,3-dione
Basic information
- CAS
7154-62-3- Standard SMILES
O=C(CC(=O)c1cc(Cl)ccc1O)c1cccnc1- InChIKey
BDLFYKPFMZISJW-UHFFFAOYSA-N- Molecular formula
- C14H10ClNO3
- Average molar mass
- 275.68 g/mol
- Monoisotopic mass
- 275.0349209
Names & identifiers
- Preferred name
- 1-(5-Chloro-2-hydroxyphenyl)-3-pyridin-3-ylpropane-1,3-dione
- IUPAC
- 1-(5-chloro-2-hydroxyphenyl)-3-pyridin-3-ylpropane-1,3-dione
Names & synonyms
7154-62-31-(5-chloro-2-hydroxyphenyl)-3-pyridin-3-ylpropane-1,3-dione1-(5-chloro-2-hydroxyphenyl)-3-(pyridin-3-yl)propane-1,3-dioneNSC7360992474-45-8SCHEMBL3951596DTXSID30919151NSC-73609
Database identifiers
- CAS
7154-62-3、92474-45-8- PubChem CID
- 252244
- DTXSID
DTXSID30919151
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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