3-Bromo-2-formylpyridine - CAS 405174-97-2

Name: 3-Bromo-2-formylpyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024548
Product Name:	3-Bromo-2-formylpyridine
CAS:	405174-97-2
Synonyms:	3-bromo-2-pyridinecarboxaldehyde; 3-bromopyridine-2-carbaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-bromopyridine-2-carbaldehyde
Description:	3-Bromo-2-formylpyridine (CAS# 405174-97-2) is a useful research chemical.
Molecular Weight:	186.01
Molecular Formula:	C6H4BrNO
Canonical SMILES:	C1=CC(=C(N=C1)C=O)Br
InChI:	InChI=1S/C6H4BrNO/c7-5-2-1-3-8-6(5)4-9/h1-4H
InChI Key:	DCOPXKMVVJNPSW-UHFFFAOYSA-N
Boiling Point:	222.989 °C at 760 mmHg
Density:	1.683 g/cm³
LogP:	1.65660

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[17746-05-3]C11H21ClO
Undecanoyl chloride
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[438616-66-1]C14H20N2O
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide

GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021111124-A1	Polyheterocyclic compounds as mettl3 inhibitors	20191202
US-2021078994-A1	MTA-Cooperative PRMT5 Inhibitors	20190912
US-2021079003-A1	MTA-Cooperative PRMT5 Inhibitors	20190912
WO-2021050915-A1	Mta-cooperative prmt5 inhibitors	20190912
WO-2021021953-A2	Dopamine receptor d1 agonists and methods of use	20190730

Complexity:	107
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.94763
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	184.94763
Rotatable Bond Count:	1
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3