2,4,6-Tri(2-pyridyl)-1,3,5-triazine - CAS 3682-35-7

Catalog:	BB023094
Product Name:	2,4,6-Tri(2-pyridyl)-1,3,5-triazine
CAS:	3682-35-7
Synonyms:	2,4,6-tris(2-pyridinyl)-1,3,5-triazine; 2,4,6-tripyridin-2-yl-1,3,5-triazine

Technical Data

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Computed Properties

IUPAC Name:	2,4,6-tripyridin-2-yl-1,3,5-triazine
Description:	2,4,6-Tri(2-pyridyl)-1,3,5-triazine (CAS# 3682-35-7) is a useful research chemical compound.
Molecular Weight:	312.33
Molecular Formula:	C18H12N6
Canonical SMILES:	C1=CC=NC(=C1)C2=NC(=NC(=N2)C3=CC=CC=N3)C4=CC=CC=N4
InChI:	InChI=1S/C18H12N6/c1-4-10-19-13(7-1)16-22-17(14-8-2-5-11-20-14)24-18(23-16)15-9-3-6-12-21-15/h1-12H
InChI Key:	KMVWNDHKTPHDMT-UHFFFAOYSA-N
Boiling Point:	618.9 °C at 760 mmHg
Density:	1.276 g/cm³
Appearance:	Solid
MDL:	MFCD00006045
LogP:	3.05760

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PMID	Publication Date	Title	Journal
22817946	20120715	Indirect method for spectrophotometric determination of ascorbic acid in pharmaceutical preparations with 2,4,6-tripyridyl-s-triazine by flow-injection analysis	Talanta
22472022	20120403	A panel of oxidative stress assays does not provide supplementary diagnostic information in Behcet's disease patients	Journal of inflammation (London, England)
22268155	20120401	Physiological and proteomic approaches to address the active role of ozone in kiwifruit post-harvest ripening	Journal of experimental botany
22412458	20120301	Bis[N-(2-hy-droxy-eth-yl)-N-methyl-dithio-carbamato-κS][2,4,6-tris-(pyridin-2-yl)-1,3,5-triazine-κN,N,N]zinc dioxane sesquisolvate	Acta crystallographica. Section E, Structure reports online
22755025	20120301	2,4,6-Tris (2-pyridyl)-1,3,5-triazine nanobelts as an effective fluorescent sensing platform for DNA detection	Journal of nanoscience and nanotechnology

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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

Complexity:	323
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	312.11234441
Formal Charge:	0
Heavy Atom Count:	24
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	312.11234441
Rotatable Bond Count:	3
Topological Polar Surface Area:	77.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1