2-Hydroxy-6-methylpyridine - CAS 3279-76-3

Name: 2-Hydroxy-6-methylpyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	6-methyl-1H-pyridin-2-one
Description:	2-Hydroxy-6-methylpyridine (CAS# 3279-76-3) is a useful research chemical.
Molecular Weight:	109.13
Molecular Formula:	C6H7NO
Canonical SMILES:	CC1=CC=CC(=O)N1
InChI:	InChI=1S/C6H7NO/c1-5-3-2-4-6(8)7-5/h2-4H,1H3,(H,7,8)
InChI Key:	JEAVIRYCMBDJIU-UHFFFAOYSA-N
Boiling Point:	281.231 °C at 760 mmHg
Melting Point:	155-160 °C
Purity:	95 %
Density:	1.121 g/cm³
Appearance:	White to cream-colored crystalline powder
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00006279
LogP:	0.68330

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

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PMID	Publication Date	Title	Journal
22452599	20120416	Influence of second coordination sphere hydroxyl groups on the reactivity of copper(I) complexes	Inorganic chemistry
22186932	20120221	Reactions of substituted pyridines with electrophilic boranes	Dalton transactions (Cambridge, England : 2003)
22029317	20111021	The S1/S2 exciton interaction in 2-pyridone·6-methyl-2-pyridone: Davydov splitting, vibronic coupling, and vibronic quenching	The Journal of chemical physics
19578263	20090701	Structural effects on the solid-state photodimerization of 2-pyridone derivatives in inclusion compounds	Acta crystallographica. Section C, Crystal structure communications
17929913	20071112	Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters	Inorganic chemistry

Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	109.052763847
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	109.052763847
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6