1-(2-Methylphenyl)cyclopropanecarbonitrile - CAS 124276-51-3

Catalog:	BB005852
Product Name:	1-(2-Methylphenyl)cyclopropanecarbonitrile
CAS:	124276-51-3
Synonyms:	1-(2-methylphenyl)-1-cyclopropanecarbonitrile; 1-(2-methylphenyl)cyclopropane-1-carbonitrile

Technical Data

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Computed Properties

IUPAC Name:	1-(2-methylphenyl)cyclopropane-1-carbonitrile
Description:	1-(2-Methylphenyl)cyclopropanecarbonitrile (CAS# 124276-51-3 ) is a useful research chemical.
Molecular Weight:	157.21
Molecular Formula:	C11H11N
Canonical SMILES:	CC1=CC=CC=C1C2(CC2)C#N
InChI:	InChI=1S/C11H11N/c1-9-4-2-3-5-10(9)11(8-12)6-7-11/h2-5H,6-7H2,1H3
InChI Key:	ZBRVAKYASUGIAX-UHFFFAOYSA-N
LogP:	2.55018

Publication Number	Title	Priority Date
US-2019352266-A1	Benzylaminopyridylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereof	20170126
US-10793530-B2	Benzylaminopyrazinylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereof	20170126
US-10919859-B2	Benzylaminopyridylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereof	20170126
US-2018148411-A1	Indanylaminopyridylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereof	20161128
EP-3544958-B1	Indanylaminopyridylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereof	20161128

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Complexity:	218
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	157.089149355
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	157.089149355
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3