2- (4-chlorophenyl) isonicotinonitrile

CAT: 0127-OR1083428-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1083428-01Size:250 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

1415250-86-0

Purity

97%

Smiles

Clc1ccc (c2cc (ccn2) C#N) cc1

Chemical Information

2-(4-Chlorophenyl)isonicotinonitrile

CAS Number	1415250-86-0
PubChem CID	117001814
IUPAC Name	2-(4-chlorophenyl)pyridine-4-carbonitrile
Molecular Formula	C12H7ClN2
Molecular Weight	214.65
XLogP	2.9
Topological Polar Surface Area	36.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	15
Formal Charge	0
Complexity	250

SMILES

C1=CC(=CC=C1C2=NC=CC(=C2)C#N)Cl

InChI

InChI=1S/C12H7ClN2/c13-11-3-1-10(2-4-11)12-7-9(8-14)5-6-15-12/h1-7H

InChIKey

FNKDZQWJEFBMGZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1415250-86-0

CID: 117001814

Formula: C12H7ClN2

MW: 214.65

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	214.65
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	214.0297759
Monoisotopic Mass	214.0297759
Topological Polar Surface Area	36.7 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	250
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1101124-01	2- (4-isopropylphenyl) isonicotinonitrile
OR14211-01	2- (4-Formylphenyl) isonicotinonitrile
PC109566-01	2- (4- (Trifluoromethyl) phenyl) isonicotinonitrile
OR1003530-01	2- ((4-Methoxybenzyl) amino) isonicotinonitrile
PC104283-01	2- (4-Trifluoromethoxy-phenoxy) isonicotinonitrile
OR111296-01	2- (4-Methylpiperazin-1-yl) isonicotinonitrile
OR76547-01	2- (Hydroxymethyl) isonicotinonitrile
OR111481-01	2- (Cyclobutylmethoxy) isonicotinonitrile
PC49309-01	2- (Trifluoromethyl) isonicotinonitrile
OR1003125-01	2- (Cyclobutylamino) isonicotinonitrile

Catalog	Name
SQB02813	2- (4-Ethylpiperazino) isonicotinonitrile
sc-320814A	2- (4-Formylphenyl) isonicotinonitrile
sc-305572A	2- (4-Methoxyphenyl) isonicotinonitrile
sc-339742	2- (3,4-dimethylphenoxy) isonicotinonitrile
sc-339770	2- (4-acetylpiperazin-1-yl) isonicotinonitrile
sc-339902A	2- (4-ethylpiperazin-1-yl) isonicotinonitrile
MBS6055062-01	4-Cyano-2-methylpyridine (2-Methyl-isonicotinonitrile)
KXB30964-01	2- (4-Aminopiperidin-1-yl) isonicotinonitrile hydrochloride
JH589315	2-Amino-5- (4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl) isonicotinonitrile
UQB56808	2- (Cyclopropylmethoxy) isonicotinonitrile