2-Acetyl-3-fluoropyridine - CAS 87674-20-2

Catalog:	BB038589
Product Name:	2-Acetyl-3-fluoropyridine
CAS:	87674-20-2
Synonyms:	1-(3-fluoro-2-pyridinyl)ethanone; 1-(3-fluoropyridin-2-yl)ethanone

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(3-fluoropyridin-2-yl)ethanone
Description:	2-Acetyl-3-fluoropyridine (CAS# 87674-20-2) is a useful research chemical.
Molecular Weight:	139.13
Molecular Formula:	C7H6FNO
Canonical SMILES:	CC(=O)C1=C(C=CC=N1)F
InChI:	InChI=1S/C7H6FNO/c1-5(10)7-6(8)3-2-4-9-7/h2-4H,1H3
InChI Key:	CCZMVVFNNQQTFC-UHFFFAOYSA-N
Boiling Point:	179.7 °C at 760 mmHg
Density:	1.175 g/cm³
LogP:	1.42330

Publication Number	Title	Priority Date
US-2020392130-A1	SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS	20190614
WO-2020249791-A1	SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS	20190614
WO-2020146636-A1	Compounds and methods for treating or preventing heart failure	20190109
US-2021214333-A1	Substituted condensed thiophenes as modulators of sting	20180516
EP-3556756-A1	Substituted propanamides as inhibitors of nucleases	20180417

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Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	139.043341977
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	139.043341977
Rotatable Bond Count:	1
Topological Polar Surface Area:	30
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1