1-(2-Fluorophenyl)cyclopropanecarbonitrile - CAS 97009-38-6

Name: 1-(2-Fluorophenyl)cyclopropanecarbonitrile
Brand: BOC Sciences
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Catalog:	BB042029
Product Name:	1-(2-Fluorophenyl)cyclopropanecarbonitrile
CAS:	97009-38-6
Synonyms:	1-(2-fluorophenyl)-1-cyclopropanecarbonitrile; 1-(2-fluorophenyl)cyclopropane-1-carbonitrile

Technical Data

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Computed Properties

IUPAC Name:	1-(2-fluorophenyl)cyclopropane-1-carbonitrile
Description:	1-(2-Fluorophenyl)cyclopropanecarbonitrile (CAS# 97009-38-6) is a useful research chemical.
Molecular Weight:	161.18
Molecular Formula:	C10H8FN
Canonical SMILES:	C1CC1(C#N)C2=CC=CC=C2F
InChI:	InChI=1S/C10H8FN/c11-9-4-2-1-3-8(9)10(7-12)5-6-10/h1-4H,5-6H2
InChI Key:	RAAFWJWXKWFSJX-UHFFFAOYSA-N
Boiling Point:	276.5 °C at 760 mmHg
Density:	1.18 g/cm³
Storage:	Sealed in dry, Room Temperature
LogP:	2.38088

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Related Functional Groups

Nitrogen Compounds

[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1281984-38-0]C8H10N4O4
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1243387-55-4]C10H8F3NO3
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[55877-31-1]C9H5NO
1-Benzofuran-3-carbonitrile
[618-40-6]C7H10N2
1-Methyl-1-phenylhydrazine
[78056-67-4]C14H18N2
2-(1-Benzyl-4-piperidyl)acetonitrile

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Publication Number	Title	Priority Date
WO-2011061760-A1	Novel antithrombotic agents	20091118
US-2009312558-A1	Process for the preparation of arylcyclopropoane carboxylic carbonitriles, and compounds derived therefrom	20080613
WO-2009150660-A1	A process for the preparation of arylcyclopropane carboxylic carbonitriles, and compounds derived therefrom	20080613
US-4859232-A	Substituted-aryl cyclopropanecarbonitriles and derivatives thereof as herbicide antidotes	19861205
FR-2552431-A1	NOVEL AZOLIC COMPOUNDS, THEIR PREPARATION AND THEIR USE AS ANTIFUNGAL AND FUNGICIDES	19830922

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.064077422
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	161.064077422
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2