Basic information
- CAS
143573-06-2- Standard SMILES
Cc1c(O)c(=O)ccn1CCCC(=O)O.Cl- InChIKey
PYRGQGNAGZYYPO-UHFFFAOYSA-N- Molecular formula
- C10H14ClNO4
- Average molar mass
- 247.67 g/mol
- Monoisotopic mass
- 247.0611356
Names & identifiers
- Preferred name
- 4-(3-Hydroxy-2-methyl-4-oxopyridin-1-yl)butanoic acid;hydrochloride
- IUPAC
- 4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)butanoic acid;hydrochloride
Names & synonyms
143573-06-2SCHEMBL9699087DTXSID207377804-(3-Hydroxy-2-methyl-4-oxopyridin-1-yl)butanoic acid;hydrochloride4-(3-Hydroxy-2-methyl-4-oxopyridin-1(4H)-yl)butanoic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
143573-06-2- PubChem CID
- 67908751
- DTXSID
DTXSID20737780
Properties
Computed structural properties
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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