AG002X5W

289470-22-0 | 3-Pyridinecarbonitrile, 6-iodo-

AG002X5W

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CAS Number	289470-22-0
Catalog Number	AG002X5W(AGN-PC-0NKWAM)
Chemical Name	3-Pyridinecarbonitrile, 6-iodo-
IUPAC Name	6-iodopyridine-3-carbonitrile
InChI	InChI=1S/C6H3IN2/c7-6-2-1-5(3-8)4-9-6/h1-2,4H
InChI Key	OSZBCDXCSFPFSX-UHFFFAOYSA-N
MDL Number	MFCD08689512
Molecular Formula	C6H3IN2
Molecular Weight	230.0059
SMILES	N#CC1=CN=C(I)C=C1
Synonyms	6-Iodonicotinonitrile, 289470-22-0, 5-Cyano-2-iodopyridine, 6-iodopyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 6-iodo-, 6-iodo-nicotinonitrile, 2-Iodo-5-cyanopyridine, ACMC-209h5s, 3-Pyridinecarbonitrile,6-iodo-, SCHEMBL12804628, CTK4G2445, DTXSID00578113, OSZBCDXCSFPFSX-UHFFFAOYSA-N, 5-cyano-2-iodopyridine AldrichCPR, ZX-AT013039, 5-cyano-2-iodopyridine, AldrichCPR, ANW-26510, MFCD08689512, OR3547, ZINC12471965, AKOS015853884, FCH1323925, RTR-012683, ACM289470220, AJ-62369, BBV-40199764, CJ-14114, AX8290540, TR-012683, CS-0082403, V4938, K-7118, J-017331, I14-25463, C6H3IN2,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.934g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	230.008g/mol
Monoisotopic Mass	229.934g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H318-H315-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 1759

Certificate of Analysis

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