Methyl 2-(6-Bromo-3-pyridyl)acetate - CAS 1256824-78-8

Catalog:	BB006227
Product Name:	Methyl 2-(6-Bromo-3-pyridyl)acetate
CAS:	1256824-78-8
Synonyms:	2-(6-bromo-3-pyridinyl)acetic acid methyl ester; methyl 2-(6-bromopyridin-3-yl)acetate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2-(6-bromopyridin-3-yl)acetate
Description:	Methyl 2-(6-Bromo-3-pyridyl)acetate (CAS# 1256824-78-8 ) is a useful research chemical.
Molecular Weight:	230.06
Molecular Formula:	C8H8BrNO2
Canonical SMILES:	COC(=O)CC1=CN=C(C=C1)Br
InChI:	InChI=1S/C8H8BrNO2/c1-12-8(11)4-6-2-3-7(9)10-5-6/h2-3,5H,4H2,1H3
InChI Key:	MUDOEYLAOIEGRI-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C

Publication Number	Title	Priority Date
AU-2018227849-A1	Aryl, heteroary, and heterocyclic pharmaceutical compounds for treatment of medical disorders	20170301
CN-110603252-A	Aryl, heteroaryl and heterocyclic pharmaceutical compounds for the treatment of medical disorders	20170301
EP-3589628-A1	Aryl, heteroary, and heterocyclic pharmaceutical compounds for treatment of medical disorders	20170301
JP-2020514331-A	Aryl, heteroaryl and heterocyclic pharmaceutical compounds for the treatment of medical disorders	20170301
US-2020071301-A1	Aryi, Heteroaryl, and Heterocyclic Pharmaceutical Compounds for Treatment of Medical Disorders	20170301

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	228.97384
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	228.97384
Rotatable Bond Count:	3
Topological Polar Surface Area:	39.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7