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1-[3-(Trifluoromethyl)phenyl]cyclobutanecarbonitrile

1-[3-(Trifluoromethyl)phenyl]cyclobutanecarbonitrile - CAS 29786-43-4

Catalog:	BB020320
Product Name:	1-[3-(Trifluoromethyl)phenyl]cyclobutanecarbonitrile
CAS:	29786-43-4
Synonyms:	1-[3-(trifluoromethyl)phenyl]-1-cyclobutanecarbonitrile; 1-[3-(trifluoromethyl)phenyl]cyclobutane-1-carbonitrile

Technical Data

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Computed Properties

IUPAC Name:	1-[3-(trifluoromethyl)phenyl]cyclobutane-1-carbonitrile
Description:	1-[3-(Trifluoromethyl)phenyl]cyclobutanecarbonitrile (CAS# 29786-43-4) is a useful research chemical.
Molecular Weight:	225.21
Molecular Formula:	C12H10F3N
Canonical SMILES:	C1CC(C1)(C#N)C2=CC(=CC=C2)C(F)(F)F
InChI:	InChI=1S/C12H10F3N/c13-12(14,15)10-4-1-3-9(7-10)11(8-16)5-2-6-11/h1,3-4,7H,2,5-6H2
InChI Key:	JOXWRFGWGJDQAK-UHFFFAOYSA-N
MDL:	MFCD10692440
LogP:	3.65068

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
CN-108699048-A	As 6 inhibitor oxadiazoles amine derivatives compounds of histone deacetylase and include the pharmaceutical composition of the compound	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

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
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[1427004-19-0]
DBCO-PEG4-NHS ester
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
[1354706-05-0]
3-Bromo-1-ethyl-5-methyl-1H-pyrazole

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Complexity:	308
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	225.07653381
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	225.07653381
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3