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Ethyl 5-bromo-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

HCID 336677
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Basic information

CAS
501688-59-1
Standard SMILES
CCOC(=O)c1cc(Br)c(=O)n(C)c1
InChIKey
LBYBRODMIMQHRQ-UHFFFAOYSA-N
Molecular formula
C9H10BrNO3
Average molar mass
260.08 g/mol
Monoisotopic mass
258.98441

Names & identifiers

Preferred name
Ethyl 5-bromo-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate
IUPAC
ethyl 5-bromo-1-methyl-6-oxopyridine-3-carboxylate

Names & synonyms

501688-59-1Ethyl 5-bromo-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylateethyl 5-bromo-1-methyl-6-oxopyridine-3-carboxylateEthyl5-bromo-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylateNSC351665DTXSID00319907NSC-351665DB-343020

Database identifiers

CAS
501688-59-1
PubChem CID
336677
DTXSID
DTXSID00319907

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
333

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