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

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 ℃ at 760 mmHg
Density:	1.65 g/cm³
MDL:	MFCD11857636
LogP:	1.72438

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

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Pyridines

[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[942206-23-7]
2,5-Dichloro-3-iodopyridine
[2122800-15-9]
3-(Phenyl-4-D)-N,N-dimethyl-3-(2-pyridyl)-1-propanamine
[1198098-45-1]
3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine
[76006-14-9]
3-Chloro-1H-pyrazolo[3,4-c]pyridine
[1122-43-6]
3-Hydroxy-2,6-dimethylpyridine

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

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