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1-(3-Chloro-2-fluorophenyl)cyclobutanecarbonitrile

1-(3-Chloro-2-fluorophenyl)cyclobutanecarbonitrile - CAS 1260825-29-3

Catalog:	BB006408
Product Name:	1-(3-Chloro-2-fluorophenyl)cyclobutanecarbonitrile
CAS:	1260825-29-3
Synonyms:	1-(3-chloro-2-fluorophenyl)-1-cyclobutanecarbonitrile; 1-(3-chloro-2-fluorophenyl)cyclobutane-1-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(3-chloro-2-fluorophenyl)cyclobutane-1-carbonitrile
Description:	1-(3-Chloro-2-fluorophenyl)cyclobutanecarbonitrile (CAS# 1260825-29-3 ) is a useful research chemical.
Molecular Weight:	209.65
Molecular Formula:	C11H9ClFN
Canonical SMILES:	C1CC(C1)(C#N)C2=C(C(=CC=C2)Cl)F
InChI:	InChI=1S/C11H9ClFN/c12-9-4-1-3-8(10(9)13)11(7-14)5-2-6-11/h1,3-4H,2,5-6H2
InChI Key:	MOWZKEBFELBELK-UHFFFAOYSA-N

Publication Number	Title	Priority Date
CA-3001666-A1	Oxadiazole amine derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same	20151012
EP-3362445-A1	Oxadiazole amine derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same	20151012
JP-2018530571-A	Oxadiazoleamine derivative compound as histone deacetylase 6 inhibitor and pharmaceutical composition containing the same	20151012
JP-6697074-B2	Oxadiazole amine derivative compound as histone deacetylase 6 inhibitor and pharmaceutical composition containing the same	20151012
KR-101839137-B1	Oxadiazole Amine Derivative Compounds as Histone Deacetylase 6 Inhibitor, and the Pharmaceutical Composition Comprising the same	20151012

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Complexity:	266
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	209.0407551
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	209.0407551
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2