Di-2-pyridyl ketone oxime - CAS 1562-95-4

Name: Di-2-pyridyl ketone oxime
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB011211
Product Name:	Di-2-pyridyl ketone oxime
CAS:	1562-95-4
Synonyms:	N-(dipyridin-2-ylmethylidene)hydroxylamine

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Computed Properties

IUPAC Name:	N-(dipyridin-2-ylmethylidene)hydroxylamine
Description:	Di-2-pyridyl ketone oxime (CAS# 1562-95-4) is a useful research chemical.
Molecular Weight:	199.21
Molecular Formula:	C11H9N3O
Canonical SMILES:	C1=CC=NC(=C1)C(=NO)C2=CC=CC=N2
InChI:	InChI=1S/C11H9N3O/c15-14-11(9-5-1-3-7-12-9)10-6-2-4-8-13-10/h1-8,15H
InChI Key:	KLOQKBNABUIDIU-UHFFFAOYSA-N
Boiling Point:	353 °C at 760 mmHg
Density:	1.21 g/cm³
Appearance:	White powder
LogP:	1.70320

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Related Functional Groups

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[76167-49-2]C11H10N2O
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[871507-15-2]C23H18N2O2
2-(Pyridin-4-yl)-1-(4-(quinolin-2-ylmethoxy)phenyl)ethan-1-one
[942206-23-7]C5H2Cl2IN
2,5-Dichloro-3-iodopyridine
[856848-33-4]C5H4Br2N2
2-Amino-4,5-dibromopyridine
[267242-99-9]C9H10ClN
2-Chloro-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine

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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
CN-110563702-A	Near-infrared fluorescent compound, preparation method and application thereof in detecting ferrous ions	20190918
CN-110563702-B	Near-infrared fluorescent compound, preparation method and application thereof in detecting ferrous ions	20190918
US-2019338080-A1	Dendrimeric metallacrowns	20180503
US-10927221-B2	Dendrimeric metallacrowns	20180503
WO-2018130227-A1	Aromatic ring-containing compound, preparation method therefor, pharmaceutical composition, and use	20170116

PMID	Publication Date	Title	Journal
20392125	20100517	Rare oxidation-state combinations and unusual structural motifs in hexanuclear Mn complexes using 2-pyridyloximate ligands	Inorganic chemistry
19006294	20081215	Unusual structural types in nickel cluster chemistry from the use of pyridyl oximes: Ni5, Ni12Na2, and Ni14 clusters	Inorganic chemistry
18844348	20081103	Ferromagnetic Dy-Ni and antiferromagnetic Dy-Cu couplings in single-molecule magnets [Dy2Ni] and [Dy2Cu]	Inorganic chemistry
18055016	20080401	Synthesis, structure and interactions with DNA of novel tetranuclear, [Mn4(II/II/II/IV)] mixed valence complexes	Journal of inorganic biochemistry
17576491	20070707	Di-2-pyridyl ketone oxime in copper chemistry: di-, tri-, penta- and hexanuclear complexes	Dalton transactions (Cambridge, England : 2003)

Complexity:	210
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.074561919
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	199.074561919
Rotatable Bond Count:	2
Topological Polar Surface Area:	58.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2