2-Chloro-5-iodonicotinonitrile - CAS 766515-34-8

Catalog:	BB035653
Product Name:	2-Chloro-5-iodonicotinonitrile
CAS:	766515-34-8
Synonyms:	2-chloro-5-iodo-3-pyridinecarbonitrile; 2-chloro-5-iodopyridine-3-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	2-chloro-5-iodopyridine-3-carbonitrile
Description:	2-Chloro-5-iodonicotinonitrile (CAS# 766515-34-8) is a useful research chemical.
Molecular Weight:	264.45
Molecular Formula:	C6H2ClIN2
Canonical SMILES:	C1=C(C(=NC=C1I)Cl)C#N
InChI:	InChI=1S/C6H2ClIN2/c7-6-4(2-9)1-5(8)3-10-6/h1,3H
InChI Key:	FYHRQFFVACXNTB-UHFFFAOYSA-N
Density:	2.13 g/cm³
LogP:	2.21128

Publication Number	Title	Priority Date
JP-2017141224-A	Pharmaceutical composition	20160210
AU-2015307873-A1	Heterobicyclic compounds and their use for the treatment of tuberculosis	20140828
AU-2015307873-B2	Heterobicyclic compounds and their use for the treatment of tuberculosis	20140828
CA-2959478-A1	Heterobicyclic compounds and their use for the treatment of tuberculosis	20140828
EP-3186240-A1	Heterobicyclic compounds and their use for the treatment of tuberculosis	20140828

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Related Functional Groups

Nitrogen Compounds

[55877-31-1]
1-Benzofuran-3-carbonitrile
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile
[2006278-12-0]
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile
[916792-07-9]
2-Bromo-4-fluoro-5-methylbenzonitrile
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[2241982-86-3]
3-(Phenyl-2-D)propanenitrile-2,2-D2

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Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	263.89512
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	263.89512
Rotatable Bond Count:	0
Topological Polar Surface Area:	36.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2