1-(4-Iodophenyl)cyclopropanecarbonitrile - CAS 124276-79-5

Catalog:	BB005859
Product Name:	1-(4-Iodophenyl)cyclopropanecarbonitrile
CAS:	124276-79-5
Synonyms:	1-(4-iodophenyl)-1-cyclopropanecarbonitrile; 1-(4-iodophenyl)cyclopropane-1-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(4-iodophenyl)cyclopropane-1-carbonitrile
Description:	1-(4-Iodophenyl)cyclopropanecarbonitrile (CAS# 124276-79-5 ) is a useful research chemical.
Molecular Weight:	269.08
Molecular Formula:	C10H8IN
Canonical SMILES:	C1CC1(C#N)C2=CC=C(C=C2)I
InChI:	InChI=1S/C10H8IN/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4H,5-6H2
InChI Key:	NYALZYNMNOTLSH-UHFFFAOYSA-N
LogP:	2.84638

Publication Number	Title	Priority Date
CN-105745212-A	Substituted 4, 5-dihydropyrazolo [3, 4-c] pyridine-2-one spirocyclic derivative, and use thereof	20131206
CN-105745212-B	The Spirocyclic derivatives of the ketone of 4,5 dihydro-pyrazolos [3,4 c] pyridine 2 of substitution and application	20131206
WO-2015081901-A1	Substituted 4, 5-dihydropyrazolo [3, 4-c] pyridine-2-one spirocyclic derivative, and use thereof	20131206
US-2013072449-A1	Lysophosphatidic acid receptor antagonists	20110320
US-8975235-B2	Lysophosphatidic acid receptor antagonists	20110320

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Complexity:	215
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	268.97015
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	268.97015
Rotatable Bond Count:	1
Topological Polar Surface Area:	23.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6