2-(2-Pyridyl)-2-propanol - CAS 37988-38-8

Catalog:	BB023481
Product Name:	2-(2-Pyridyl)-2-propanol
CAS:	37988-38-8
Synonyms:	2-(2-pyridinyl)-2-propanol; 2-pyridin-2-ylpropan-2-ol

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Computed Properties

IUPAC Name:	2-pyridin-2-ylpropan-2-ol
Description:	2-(2-Pyridyl)-2-propanol (CAS# 37988-38-8 ) is a useful research chemical.
Molecular Weight:	137.18
Molecular Formula:	C8H11NO
Canonical SMILES:	CC(C)(C1=CC=CC=N1)O
InChI:	InChI=1S/C8H11NO/c1-8(2,10)7-5-3-4-6-9-7/h3-6,10H,1-2H3
InChI Key:	LUZJNRNNOOBBDY-UHFFFAOYSA-N
Boiling Point:	226.8 °C at 760 mmHg
Density:	1.052 g/cm³
LogP:	1.30900

Publication Number	Title	Priority Date
WO-2020102576-A1	Compounds and compositions for treating conditions associated with nlrp activity	20181116
WO-2019135600-A1	Novel metal complex, method for producing same, and method for producing gamma-lactam compound using same	20180102
WO-2019135604-A1	Method for producing lactam compound, and lactam compound produced thereby	20180102
US-2020330969-A1	Novel metal complex, method for producing same, and method for producing gamma-lactam compound using same	20180102
US-2020331871-A1	Method for producing lactam compound, and lactam compound produced thereby	20180102

PMID	Publication Date	Title	Journal
22594951	20120613	Particle formation during oxidation catalysis with Cp* iridium complexes	Journal of the American Chemical Society
21522289	20110223	Acetonitrile-[2-(1-{bis-[2,4,6-tris-(trifluoro-meth-yl)phen-yl]phosphan-yloxy}-1-methyl-eth-yl)pyridine]-methyl-palladium(II) hexa-fluoridoanti-monate dichloro-methane hemisolvate	Acta crystallographica. Section E, Structure reports online
19961209	20100104	Mn(7) and Mn(12) clusters from use of 2-(pyridine-2-yl)propan-2-ol: a new half-integer single-molecule magnet	Inorganic chemistry
15236535	20040712	Dinuclear nickel complexes with bidentate N,O ligands: synthesis, structure, and catalytic oligomerization of ethylene	Inorganic chemistry

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Complexity:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.084063974
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	137.084063974
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6