Ethyl 5-bromo-2-methylpyridine-3-carboxylate

C9H10BrNO2CAS 129477-21-0244.09 g/mol

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OONBr
Aryl halideEster

Properties

Molecular formula
C9H10BrNO2
Molar mass
244.09 g/mol
Exact mass
242.9895 Da
logP
2.33Crippen estimate
Polar surface area
39.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
129477-21-0
SMILES
CCOC(=O)C1=C(N=CC(=C1)Br)C
InChIKey
QVKPPFGWQMCQCI-UHFFFAOYSA-N
InChI
InChI=1S/C9H10BrNO2/c1-3-13-9(12)8-4-7(10)5-11-6(8)2/h4-5H,3H2,1-2H3

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Names and synonyms

1 names
  • 5-Bromo-2-methyl-nicotinic acid ethyl ester

Work with Ethyl 5-bromo-2-methylpyridine-3-carboxylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl 5-bromopyridine-3-carboxylate20986-40-757 % similar Ethyl 2-methyl-3-pyridinecarboxylate1721-26-256 % similar Ethyl 5-bromopicolinate77199-09-856 % similar Ethyl 2-chloro-4-methylpyrimidine-5-carboxylate188781-08-053 % similar Ethyl 5-bromo-2-chlorobenzoate76008-73-653 % similar Diethyl 2,5-dibromobenzene-1,4-dicarboxylate18013-97-353 % similar Ethyl-2-methylthio-4-methyl-5-pyrimidine carboxylate7234-25-550 % similar Ethyl 3-methylpyrazole-4-carboxylate85290-78-450 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Methyl 3-amino-5-bromo-2-methylbenzoate1000342-11-9 Dl-beta-(3-bromophenyl)alanine117391-50-1 4-Bromophenylalanine14091-15-7 4-Bromo-L-phenylalanine24250-84-8 (2R)-2-Amino-3-(2-bromophenyl)propanoic acid267225-27-4 (S)-3-Amino-3-(3-bromo-phenyl)-propionic acid275826-35-2 (S)-β-Amino-β-(4-bromophenyl)propionic acid275826-36-3 2-Bromophenylalanine42538-40-9

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