8-Fluoro-2H-benzo[b][1,4]oxazin-3(4H)-one - CAS 560082-51-1

Catalog:	BB029235
Product Name:	8-Fluoro-2H-benzo[b][1,4]oxazin-3(4H)-one
CAS:	560082-51-1
Synonyms:	8-fluoro-4H-1,4-benzoxazin-3-one; 8-fluoro-4H-1,4-benzoxazin-3-one

Technical Data

Patents

Computed Properties

IUPAC Name:	8-fluoro-4H-1,4-benzoxazin-3-one
Description:	8-Fluoro-2H-benzo[b][1,4]oxazin-3(4H)-one (CAS# 560082-51-1) is a useful research chemical.
Molecular Weight:	167.14
Molecular Formula:	C8H6FNO2
Canonical SMILES:	C1C(=O)NC2=C(O1)C(=CC=C2)F
InChI:	InChI=1S/C8H6FNO2/c9-5-2-1-3-6-8(5)12-4-7(11)10-6/h1-3H,4H2,(H,10,11)
InChI Key:	DTRPZILXGOFOKO-UHFFFAOYSA-N
LogP:	1.24170

Publication Number	Title	Priority Date
KR-20200131246-A	Heterocyclic compounds as kinase inhibitors	20180215
JP-2021514359-A	Heterocyclic compounds as kinase inhibitors	20180215
WO-2016027249-A1	Tricyclic nitrogen containing compounds for treating neisseria gonorrhoea infection	20140822
CA-2932056-A1	Fused imidazole and pyrazole derivatives as modulators of tnf activity	20131209
EP-3080115-A1	Fused imidazole and pyrazole derivatives as modulators of tnf activity	20131209

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Related Functional Groups

Benzoxazines

[1780189-83-4]
5-Methoxy-1H-benzo[d][1,3]oxazin-2(4H)-one
[154598-52-4]
(S)-6-Chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one
[928256-37-5]
6-Methoxy-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one
[29883-25-8]
(S)-3-Amino-piperidine-2,6-dione
[5735-53-5]
3,4-Dihydro-2H-1,4-benzoxazine
[1542255-76-4]
5-Fluoro-2,2-dimethyl-2H-benzo[b][1,4]oxazin-3(4H)-one

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Complexity:	198
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	167.0382566
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	167.0382566
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1