AG0076N4

405224-22-8 | 5-Bromo-2-oxo-2,3-dihydropyridine-3-carbonitrile

AG0076N4

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CAS Number	405224-22-8
Catalog Number	AG0076N4(AGN-PC-0LXLE7)
Chemical Name	5-Bromo-2-oxo-2,3-dihydropyridine-3-carbonitrile
IUPAC Name	5-bromo-2-oxo-1H-pyridine-3-carbonitrile
InChI	InChI=1S/C6H3BrN2O/c7-5-1-4(2-8)6(10)9-3-5/h1,3H,(H,9,10)
InChI Key	SWTLLSLCDHXNIU-UHFFFAOYSA-N
MDL Number	MFCD07363806
Molecular Formula	C6H3BrN2O
Molecular Weight	199.0048
SMILES	N#CC(C=C(Br)C=N1)C1=O
Synonyms	405224-22-8, 5-Bromo-2-hydroxynicotinonitrile, 5-BROMO-3-CYANO-2(1H)-PYRIDINONE, 5-bromo-2-hydroxypyridine-3-carbonitrile, 5-Bromo-3-Cyano-2-Hydroxypyridine, 5-bromo-2-oxo-1,2-dihydropyridine-3-carbonitrile, 3-CYANO-5-BROMO-2-HYDROXYPYRIDINE, 5-bromo-2-oxo-1H-pyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 5-bromo-1,2-dihydro-2-oxo-, MFCD07363806, PubChem17540, ACMC-209jez, AC1OH3BC, SCHEMBL459834, CTK4I3274, CTK7C7099, DTXSID10428392, SWTLLSLCDHXNIU-UHFFFAOYSA-N, 5-bromo-3-cyano-2(1h)-pyridone, ABBYPHARMA AP-18-5725, ZX-AT004081, ANW-29433, FCH921438, OR5766, RW3592, SBB092404, ZINC12471472, 5-BROMO-3-CYANO-2-PYRIDINOL, AKOS005072724, AKOS013153971, AC-9427, AM86948, FS-3771, GC-0703, MCULE-7768650180, PB30875, QC-2153, RP04182, ACM405224228, AJ-62306, AN-28434, BBV-38359385, BC004258, BR-30401, SC-93764, SY021373, AB0024765, AB0070907, DB-070032, 4CH-002691, A6777, FT-0647109, ST24032940, W6102, MFCD13184828 (95%), B-3526, EN300-127450, 2-Oxo-5-bromo-1,2-dihydropyridine-3-carbonitrile, 224B228, 3-Pyridinecarbonitrile,5-bromo-1,2-dihydro-2-oxo-, 5-Bromo-2-oxo-1,2 dihydro-pyridine-3-carbonitrile, 5-Bromo-2-oxo-1,2-dihydro-pyridine-3-carbonitrile, I02-2663, J-516944, C6H3BrN2O, ZINC04352726, CID7204870, 5-Bromo-2-oxo-2,3-dihydropyridine-3-carbonitrile, N/A,

Complexity	281
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.943g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	199.007g/mol
Monoisotopic Mass	197.943g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number