2-(4-Chlorobenzoyl)-5-methylpyridine
Basic information
- CAS
1187166-39-7- Standard SMILES
Cc1ccc(C(=O)c2ccc(Cl)cc2)nc1- InChIKey
GUXASJFOAWGKRJ-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO
- Average molar mass
- 231.68 g/mol
- Monoisotopic mass
- 231.0450916
Names & identifiers
- Preferred name
- 2-(4-Chlorobenzoyl)-5-methylpyridine
- IUPAC
- (4-chlorophenyl)-(5-methyl-2-pyridinyl)methanone
Names & synonyms
1187166-39-72-(4-Chlorobenzoyl)-5-methylpyridine(4-Chlorophenyl)(5-methylpyridin-2-yl)methanoneMFCD14581699(4-chlorophenyl)-(5-methylpyridin-2-yl)methanoneDTXSID201241215AKOS016018956(4-Chlorophenyl)(5-methyl-2-pyridinyl)methanone(4-chlorophenyl)-(5-methyl-2-pyridyl)methanoneF202856
Database identifiers
- CAS
1187166-39-7- PubChem CID
- 49762015
- DTXSID
DTXSID201241215
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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