2-Chloro-6-phenylnicotinonitrile - CAS 43083-14-3

Name: 2-Chloro-6-phenylnicotinonitrile
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB025316
Product Name:	2-Chloro-6-phenylnicotinonitrile
CAS:	43083-14-3
Synonyms:	2-chloro-6-phenyl-3-pyridinecarbonitrile; 2-chloro-6-phenylpyridine-3-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	2-chloro-6-phenylpyridine-3-carbonitrile
Description:	2-Chloro-6-phenylnicotinonitrile (CAS# 43083-14-3) is a useful research chemical.
Molecular Weight:	214.65
Molecular Formula:	C12H7ClN2
Canonical SMILES:	C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)Cl
InChI:	InChI=1S/C12H7ClN2/c13-12-10(8-14)6-7-11(15-12)9-4-2-1-3-5-9/h1-7H
InChI Key:	NROZOMIVAHCNED-UHFFFAOYSA-N
Boiling Point:	376.4 °C at 760 mmHg
Density:	1.3 g/cm³
MDL:	MFCD01316320
LogP:	3.27368

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Related Functional Groups

Nitrogen Compounds

[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
[55877-31-1]C9H5NO
1-Benzofuran-3-carbonitrile
[2006278-12-0]C13H9BrN2O
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile

Publication Number	Title	Priority Date
AU-2015302908-A1	Inhibitors of tryptophan dioxygenases (IDO1 and TDO) and their use in therapy	20140813
AU-2015302908-B2	Inhibitors of tryptophan dioxygenases (IDO1 and TDO) and their use in therapy	20140813
AU-2020203116-A1	INHIBITORS OF TRYPTOPHAN DIOXYGENASES (IDO1 and TDO) AND THEIR USE IN THERAPY	20140813
CA-2957884-A1	Inhibitors of tryptophan dioxygenases (ido1 and tdo) and their use in therapy	20140813
EP-3180002-A1	Inhibitors of tryptophan dioxygenases (ido1 and tdo) and their use in therapy	20140813

Complexity:	252
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.0297759
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	214.0297759
Rotatable Bond Count:	1
Topological Polar Surface Area:	36.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2