5-Chloro-2,3-dimethylpyridine
Basic information
- CAS
72093-08-4- Standard SMILES
Cc1cc(Cl)cnc1C- InChIKey
PKZCOALHYWZNHP-UHFFFAOYSA-N- Molecular formula
- C7H8ClN
- Average molar mass
- 141.6 g/mol
- Monoisotopic mass
- 141.034527
Names & identifiers
- Preferred name
- 5-Chloro-2,3-dimethylpyridine
- IUPAC
- 5-chloro-2,3-dimethylpyridine
- English name
- Pyridine, 5-chloro-2,3-dimethyl-
- Molecular formula
- C7H8ClN
- Molecular weight
- 141.6
Names & synonyms
5-CHLORO-2,3-DIMETHYLPYRIDINE72093-08-4Pyridine, 5-chloro-2,3-dimethyl-SCHEMBL2112692SCHEMBL3838346SCHEMBL27677965DTXSID901307002AB75734
Database identifiers
- CAS
72093-08-4- PubChem CID
- 12508370
- DTXSID
DTXSID901307002
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 94.9
Physicochemical properties
- Boiling point
- 196.1 · 196.1±35.0 °C(Predicted)
- Density
- 1.113 · 1.113±0.06 g/cm3(Predicted)
- pka
- 3.96 · 3.96±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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