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1-(3,5-Difluorophenyl)cyclobutanecarbonitrile

1-(3,5-Difluorophenyl)cyclobutanecarbonitrile - CAS 1249471-25-7

Catalog:	BB006022
Product Name:	1-(3,5-Difluorophenyl)cyclobutanecarbonitrile
CAS:	1249471-25-7
Synonyms:	1-(3,5-difluorophenyl)-1-cyclobutanecarbonitrile; 1-(3,5-difluorophenyl)cyclobutane-1-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(3,5-difluorophenyl)cyclobutane-1-carbonitrile
Description:	1-(3,5-Difluorophenyl)cyclobutanecarbonitrile (CAS# 1249471-25-7 ) is a useful research chemical.
Molecular Weight:	193.19
Molecular Formula:	C11H9F2N
Canonical SMILES:	C1CC(C1)(C#N)C2=CC(=CC(=C2)F)F
InChI:	InChI=1S/C11H9F2N/c12-9-4-8(5-10(13)6-9)11(7-14)2-1-3-11/h4-6H,1-3H2
InChI Key:	OJGJWXQDRWERLC-UHFFFAOYSA-N

Publication Number	Title	Priority Date
AU-2016338118-A1	Oxadiazole amine derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same	20151012
AU-2016338118-B2	Oxadiazole amine derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same	20151012
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

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Complexity:	254
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	193.07030562
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	193.07030562
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7