Methyl 6-Amino-5-bromopicolinate - CAS 178876-82-9

Name: Methyl 6-Amino-5-bromopicolinate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB013509
Product Name:	Methyl 6-Amino-5-bromopicolinate
CAS:	178876-82-9
Synonyms:	6-amino-5-bromo-2-pyridinecarboxylic acid methyl ester; methyl 6-amino-5-bromopyridine-2-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	methyl 6-amino-5-bromopyridine-2-carboxylate
Description:	Used in the preparation of aminopyridinamides as sodium channel modulators.
Molecular Weight:	231.05
Molecular Formula:	C7H7BrN2O2
Canonical SMILES:	COC(=O)C1=NC(=C(C=C1)Br)N
InChI:	InChI=1S/C7H7BrN2O2/c1-12-7(11)5-3-2-4(8)6(9)10-5/h2-3H,1H3,(H2,9,10)
InChI Key:	OQUCMNQHZFOMPC-UHFFFAOYSA-N
Boiling Point:	359.186 °C at 760 mmHg
Density:	1.662 g/cm³
MDL:	MFCD08062950
LogP:	1.79410

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Related Functional Groups

Pyridines

[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide
[1261365-99-4]C6H5Cl2NO2
2,5-Dichloro-6-(hydroxymethyl)pyridin-3-ol
[63585-69-3]C6H7ClN2O2
2-Methyl-3-nitropyridine Hydrochloride
[2122800-15-9]C16H19N2D
3-(Phenyl-4-D)-N,N-dimethyl-3-(2-pyridyl)-1-propanamine
[144584-32-7]C5H2BrCl2N
3-Bromo-2,4-dichloropyridine
[133928-61-7]C12H9ClN2O
4-Chloro-N-phenylpicolinamide

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Complexity:	177
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	229.96909
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	229.96909
Rotatable Bond Count:	2
Topological Polar Surface Area:	65.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4