Di(2-pyridyl) ketone - CAS 19437-26-4

Name: Di(2-pyridyl) ketone
Brand: BOC Sciences
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Catalog:	BB015056
Product Name:	Di(2-pyridyl) ketone
CAS:	19437-26-4
Synonyms:	dipyridin-2-ylmethanone

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Computed Properties

IUPAC Name:	dipyridin-2-ylmethanone
Description:	Di(2-pyridyl) ketone (CAS# 19437-26-4) is a useful research chemical.
Molecular Weight:	184.19
Molecular Formula:	C11H8N2O
Canonical SMILES:	C1=CC=NC(=C1)C(=O)C2=CC=CC=N2
InChI:	InChI=1S/C11H8N2O/c14-11(9-5-1-3-7-12-9)10-6-2-4-8-13-10/h1-8H
InChI Key:	QPOWUYJWCJRLEE-UHFFFAOYSA-N
Boiling Point:	343.5 °C at 760 mmHg
Density:	1.196 g/cm³
Appearance:	Beige to brown crystalline powder
MDL:	MFCD00006288
LogP:	1.70760

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

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
[202288-73-1]C12H14Cl2N2O
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[942206-23-7]C5H2Cl2IN
2,5-Dichloro-3-iodopyridine
[267242-99-9]C9H10ClN
2-Chloro-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
[63585-69-3]C6H7ClN2O2
2-Methyl-3-nitropyridine Hydrochloride

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ML-SI3

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
US-2020395554-A1	Compound and organic electro-optical device containing the same	20200515
US-2020227655-A1	Compound, display panel, and display apparatus	20200103
US-2021191266-A1	Resin, resist composition and method for producing resist pattern, and compound	20191218
WO-2021124114-A1	Composition including unsaturated polyester resin, epoxy resin, and photoinitiator and method of using the same	20191218
EP-3828951-A1	Organic electronic device and display device comprising the organic electronic device as well as organic compounds for use in organic electronic devices	20191127

PMID	Publication Date	Title	Journal
22930349	20121021	The 'periodic table' of di-2-pyridyl ketone: vanadium complexes	Dalton transactions (Cambridge, England : 2003)
22562120	20120621	Exploring synthetic pathways to cationic heteroleptic cyclometalated iridium complexes derived from dipyridylketone	Dalton transactions (Cambridge, England : 2003)
22087633	20120619	Direct functionalization of M-C (M = Pt(II), Pd(II)) bonds using environmentally benign oxidants, O2 and H2O2	Accounts of chemical research
22668075	20120618	A heterometallic (Ni(II)-Cu(II)) decanuclear cluster containing two distorted cubane-like pentanuclear cores: synthesis, structure, and magnetic properties	Inorganic chemistry
22362375	20120607	Heterocyclic dithiocarbazate iron chelators: Fe coordination chemistry and biological activity	Dalton transactions (Cambridge, England : 2003)

Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.063662883
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	184.063662883
Rotatable Bond Count:	2
Topological Polar Surface Area:	42.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8