1-(3-Chlorophenyl)cyclopropanecarbonitrile - CAS 124276-32-0

Catalog:	BB005847
Product Name:	1-(3-Chlorophenyl)cyclopropanecarbonitrile
CAS:	124276-32-0
Synonyms:	1-(3-chlorophenyl)-1-cyclopropanecarbonitrile; 1-(3-chlorophenyl)cyclopropane-1-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(3-chlorophenyl)cyclopropane-1-carbonitrile
Description:	1-(3-Chlorophenyl)cyclopropanecarbonitrile (CAS# 124276-32-0) is a useful research chemical.
Molecular Weight:	177.63
Molecular Formula:	C10H8ClN
Canonical SMILES:	C1CC1(C#N)C2=CC(=CC=C2)Cl
InChI:	InChI=1S/C10H8ClN/c11-9-3-1-2-8(6-9)10(7-12)4-5-10/h1-3,6H,4-5H2
InChI Key:	DHNLVTGCFXWYFU-UHFFFAOYSA-N
Boiling Point:	316.5 °C at 760 mmHg
Density:	1.24 g/cm³
Appearance:	Colorless low-melting solid
Storage:	Sealed in dry, Room Temperature
LogP:	2.89518

Publication Number	Title	Priority Date
US-10562869-B2	Oxadiazole compounds	20140317
US-2017073319-A1	Oxadiazole compounds	20140317
US-2020140400-A1	Oxadiazole compounds	20140317
AU-2008232683-A1	Quinoline derivatives and pharmaceutical compositions comprising them for selectin inhibition	20070330
BR-PI0809509-A2	COMPOUND, PHARMACEUTICAL COMPOSITION, METHODS TO INHIBIT INTRACELLULAR ADHESION MEDIATED BY SELECTIN, AND TO TREAT OR PREVENT DISEASE OR DISORDER IN A MAMMALIAN, AND USE OF A COMPOUND.	20070330

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[32894-07-8]
Benzyl thioacetimidate hydrochloride
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.034527
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	177.034527
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5