Methyl 2-(4-bromo-2-pyridyl)acetate - CAS 1354021-08-1

Name: Methyl 2-(4-bromo-2-pyridyl)acetate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB008163
Product Name:	Methyl 2-(4-bromo-2-pyridyl)acetate
CAS:	1354021-08-1
Synonyms:	2-(4-bromo-2-pyridinyl)acetic acid methyl ester; methyl 2-(4-bromopyridin-2-yl)acetate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2-(4-bromopyridin-2-yl)acetate
Description:	Methyl 2-(4-bromo-2-pyridyl)acetate (CAS# 1354021-08-1 ) is a useful research chemical.
Molecular Weight:	230.06
Molecular Formula:	C8H8BrNO2
Canonical SMILES:	COC(=O)CC1=NC=CC(=C1)Br
InChI:	InChI=1S/C8H8BrNO2/c1-12-8(11)5-7-4-6(9)2-3-10-7/h2-4H,5H2,1H3
InChI Key:	URIFFMIHLPERQQ-UHFFFAOYSA-N
Storage:	Inert atmosphere, Store in freezer, under -20 °C
LogP:	1.55960

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Related Functional Groups

Carbonyl Compounds

[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]C11H21ClO
Undecanoyl chloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

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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:	1.4