5-Bromo-3-methoxypicolinonitrile - CAS 36057-46-2

Name: 5-Bromo-3-methoxypicolinonitrile
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB022843
Product Name:	5-Bromo-3-methoxypicolinonitrile
CAS:	36057-46-2
Synonyms:	5-bromo-3-methoxypyridine-2-carbonitrile

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-bromo-3-methoxypyridine-2-carbonitrile
Description:	5-Bromo-3-methoxypicolinonitrile (CAS# 36057-46-2) is a useful research chemical.
Molecular Weight:	213.03
Molecular Formula:	C7H5BrN2O
Canonical SMILES:	COC1=CC(=CN=C1C#N)Br
InChI:	InChI=1S/C7H5BrN2O/c1-11-7-2-5(8)4-10-6(7)3-9/h2,4H,1H3
InChI Key:	WIRVBLLSXJUOHZ-UHFFFAOYSA-N
Boiling Point:	310.9 °C at 760 mmHg
Density:	1.65 g/cm³
MDL:	MFCD11857636
LogP:	1.72438

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Related Functional Groups

Nitrogen 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
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
[2006278-12-0]C13H9BrN2O
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile

Pyridines

[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1951441-75-0]C8H13ClN2O
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride
[149463-07-0]C6H6Cl2FN
2-(Chloromethyl)-3-fluoropyridine Hydrochloride
[1261365-99-4]C6H5Cl2NO2
2,5-Dichloro-6-(hydroxymethyl)pyridin-3-ol
[144584-32-7]C5H2BrCl2N
3-Bromo-2,4-dichloropyridine
[1087659-19-5]C14H12N2O4
3-Methoxy-5-(phenylcarbamoyl)isonicotinic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112390852-A	Compound as protein degradation agent and preparation method and application thereof	20190814
WO-2020231977-A1	Compounds for treating huntington's disease	20190513
WO-2020108579-A1	Amino-substituted pyridone derivative, preparation method therefor, and pharmaceutical use thereof	20181128
CN-111712490-A	Amino-substituted pyridone derivatives, preparation method and medical application thereof	20181128
WO-2020070088-A1	Flavone derivatives for the treatment and prophylaxis of hepatitis b virus disease	20181003

Complexity:	177
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.95853
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	211.95853
Rotatable Bond Count:	1
Topological Polar Surface Area:	45.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6