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Structure

2-Pyridinecarboxylic acid, 3-amino-4-bromo-6-chloro-, ethyl ester

CAS
1823960-33-3
Catalog Number
ACM1823960333
Category
Pyridines
Molecular Weight
279.52
Molecular Formula
C8H8BrClN2O2

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Specification

IUPAC Name
Ethyl 3-amino-4-bromo-6-chloropyridine-2-carboxylate
Canonical SMILES
CCOC(=O)C1=C(C(=CC(=N1)Cl)Br)N
InChI
InChI=1S/C8H8BrClN2O2/c1-2-14-8(13)7-6(11)4(9)3-5(10)12-7/h3H,2,11H2,1H3
InChI Key
PDGKITLDLAYJSA-UHFFFAOYSA-N
Complexity
218
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Exact Mass
277.94577
Heavy Atom Count
14
Monoisotopic Mass
277.94577
Physical State
Solid
Topological Polar Surface Area
65.2 Ų
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