5-Methyl-2,2'-bipyridine - CAS 56100-20-0

Catalog:	BB029254
Product Name:	5-Methyl-2,2'-bipyridine
CAS:	56100-20-0
Synonyms:	5-methyl-2-(2-pyridinyl)pyridine; 5-methyl-2-pyridin-2-ylpyridine

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Computed Properties

IUPAC Name:	5-methyl-2-pyridin-2-ylpyridine
Description:	5-Methyl-2,2'-bipyridine (CAS# 56100-20-0) is an intermediate in the synthesis of genetic incorporation of a metal-ion chelating amino acids into proteins as a biophysical probe.
Molecular Weight:	170.21
Molecular Formula:	C11H10N2
Canonical SMILES:	CC1=CN=C(C=C1)C2=CC=CC=N2
InChI:	InChI=1S/C11H10N2/c1-9-5-6-11(13-8-9)10-4-2-3-7-12-10/h2-8H,1H3
InChI Key:	LECLRDWVJRSFSE-UHFFFAOYSA-N
Boiling Point:	300.083 ℃ at 760 mmHg
Density:	1.081 g/cm³
MDL:	MFCD08062569
LogP:	2.45200

Publication Number	Title	Priority Date
CN-111518145-A	Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof	20200507
WO-2021120838-A1	Organic compound, electronic device, and electronic apparatus	20191219
US-2020350505-A1	Organometallic compound, organic light-emitting device including organometallic compound, and apparatus including organometallic compound	20190503
CN-110416586-A	Iron-based flow battery and its positive and negative anodes electrolyte and preparation method	20190328
CN-110416586-B	Iron-based flow battery, positive and negative electrolyte thereof and preparation method	20190328

PMID	Publication Date	Title	Journal
21249254	20110227	Metal-mediated aggregation of DNA comprising 2,2'-bipyridine nucleoside, an asymmetrically substituted chiral bidentate ligand	Dalton transactions (Cambridge, England : 2003)
15530087	20041115	Influence of anionic functions on the coordination and photophysical properties of lanthanide(III) complexes with tridentate bipyridines	Inorganic chemistry

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Complexity:	158
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	170.084398327
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	170.084398327
Rotatable Bond Count:	1
Topological Polar Surface Area:	25.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1