2-Hydroxy-1-(3-pyridyl)ethanone - CAS 104501-59-9

Catalog:	BB001405
Product Name:	2-Hydroxy-1-(3-pyridyl)ethanone
CAS:	104501-59-9
Synonyms:	2-hydroxy-1-(3-pyridinyl)ethanone; 2-hydroxy-1-pyridin-3-ylethanone

Technical Data

Patents

Computed Properties

IUPAC Name:	2-hydroxy-1-pyridin-3-ylethanone
Description:	2-Hydroxy-1-(3-pyridyl)ethanone (CAS# 104501-59-9 ) is a useful research chemical.
Molecular Weight:	137.14
Molecular Formula:	C7H7NO2
Canonical SMILES:	C1=CC(=CN=C1)C(=O)CO
InChI:	InChI=1S/C7H7NO2/c9-5-7(10)6-2-1-3-8-4-6/h1-4,9H,5H2
InChI Key:	APHOGJYLIQFYOL-UHFFFAOYSA-N
Boiling Point:	290.6 °C at 760 mmHg
Density:	1.227 g/cm³
LogP:	0.25660

Publication Number	Title	Priority Date
US-2015011760-A1	Difluoromethylation Of Unsaturated Compounds	20111201
US-9464087-B2	Difluoromethylation of unsaturated compounds	20111201
US-2014234759-A1	Actinic ray- or radiation-sensitive resin composition, actinic ray- or radiation-sensitive film and method of forming pattern	20110930
KR-101286617-B1	Method for preparing ï¼»1,2,3ï¼½-oxathiazolidine-2,2-dioxide or ï¼»1,2,5ï¼½-thiadiazolidine-1,1-dioxide derivatives	20100621
KR-20110138600-A	Process for preparing [1,2,3] -oxathiazolidine-2,2-dioxide or [1,2,5] -thiadiazolidine-1,1-dioxide derivative	20100621

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Complexity:	125
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.047678466
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	137.047678466
Rotatable Bond Count:	2
Topological Polar Surface Area:	50.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.2