2'-Fluoro-2-hydroxyacetophenone - CAS 218771-68-7

Catalog:	BB017184
Product Name:	2'-Fluoro-2-hydroxyacetophenone
CAS:	218771-68-7
Synonyms:	1-(2-fluorophenyl)-2-hydroxyethanone; 1-(2-fluorophenyl)-2-hydroxyethanone

Technical Data

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Computed Properties

IUPAC Name:	1-(2-fluorophenyl)-2-hydroxyethanone
Description:	2'-Fluoro-2-hydroxyacetophenone (CAS# 218771-68-7 ) is a useful research chemical.
Molecular Weight:	154.14
Molecular Formula:	C8H7FO2
Canonical SMILES:	C1=CC=C(C(=C1)C(=O)CO)F
InChI:	InChI=1S/C8H7FO2/c9-7-4-2-1-3-6(7)8(11)5-10/h1-4,10H,5H2
InChI Key:	SBOHDDBYYFDPES-UHFFFAOYSA-N
LogP:	1.00070

Publication Number	Title	Priority Date
TW-201829394-A	6-amino-5-fluoro-5-(fluoromethyl)-2,3,4,5-tetrahydropyridin-2-yl-phenyl-5-(methoxy-D3)-pyrazine-2-carboxamides and fluorinated derivatives thereof as BACE1 inhibitors	20161221
US-2018186769-A1	6-amino-5-fluoro-5-(fluoromethyl)-2,3,4,5-tetrahydropyridin-2-yl-phenyl-5-(methoxy-d3)-pyrazine-2-carboxamides and fluorinated derivatives thereof as bace1 inhibitors	20161221
WO-2018114910-A1	6-amino-5-fluoro-5-(fluoromethyl)-2,3,4,5-tetrahydropyridin-2-yl-phenyl-5-(methoxy-d3)-pyrazine-2-carboxamides and fluorinated derivatives thereof as bace1 inhibitors	20161221
CN-106316813-B	3-substituted 3-vinyl-2-hydroxy-1-aryl acetone and synthesis method thereof	20160816
AU-2016305275-A1	2-amino-3-fluoro-3-(fluoromethyl)-6-methyl-6-phenyl-3,4,5,6-tetrahydropyridins as bace1 inhibitors	20150812

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Complexity:	147
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.04300762
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	154.04300762
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1