2,2'-Pyridil - CAS 492-73-9

Catalog:	BB026677
Product Name:	2,2'-Pyridil
CAS:	492-73-9
Synonyms:	1,2-dipyridin-2-ylethane-1,2-dione

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Computed Properties

IUPAC Name:	1,2-dipyridin-2-ylethane-1,2-dione
Description:	2,2'-Pyridil (CAS# 492-73-9 ) is a useful research chemical.
Molecular Weight:	212.20
Molecular Formula:	C12H8N2O2
Canonical SMILES:	C1=CC=NC(=C1)C(=O)C(=O)C2=CC=CC=N2
InChI:	InChI=1S/C12H8N2O2/c15-11(9-5-1-3-7-13-9)12(16)10-6-2-4-8-14-10/h1-8H
InChI Key:	PIINXYKJQGMIOZ-UHFFFAOYSA-N
Boiling Point:	400 °C at 760 mmHg
Melting Point:	154-156 °C
Purity:	95 %
Density:	1.271 g/cm³
LogP:	1.54220

Publication Number	Title	Priority Date
CN-112174882-A	Environment-friendly preparation method of chromium picolinate	20200929
US-11104588-B1	Solar distillation system with integrated cooling and controller	20200414
US-2021317008-A1	Method for producing fresh water from saline water using solar energy	20200414
US-2021207019-A1	Method of removing iron-containing scale from a wellbore, pipe, or surface using a biodegradable descaler solution	20200103
US-2020345712-A1	Compositions and methods for treating cancer	20190503

PMID	Publication Date	Title	Journal
21580039	20091216	2-Phenyl-4,5-di-2-pyridyl-1H-imidazole	Acta crystallographica. Section E, Structure reports online
21578333	20091017	N-(1H-1,2,4-Triazol-5-yl)pyridine-2-carboxamide	Acta crystallographica. Section E, Structure reports online
19062296	20090101	Comparison of benzil and trifluoromethyl ketone (TFK)-mediated carboxylesterase inhibition using classical and 3D-quantitative structure-activity relationship analysis	Bioorganic & medicinal chemistry
18790639	20081001	2,2'-Pyridoin derivatives protect HL-60 cells against oxidative stress	Bioorganic & medicinal chemistry letters
17362003	20070411	Dehydrogenation of aromatic molecules under a scanning tunneling microscope: pathways and inelastic spectroscopy simulations	Journal of the American Chemical Society

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	250
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	212.058577502
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	212.058577502
Rotatable Bond Count:	3
Topological Polar Surface Area:	59.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4