AG002ACS

20577-27-9 | 3-Pyridinecarbonitrile, 1,2-dihydro-2-oxo-

AG002ACS

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CAS Number	20577-27-9
Catalog Number	AG002ACS(AGN-PC-0JT6QD)
Chemical Name	3-Pyridinecarbonitrile, 1,2-dihydro-2-oxo-
IUPAC Name	2-oxo-1H-pyridine-3-carbonitrile
InChI	InChI=1S/C6H4N2O/c7-4-5-2-1-3-8-6(5)9/h1-3H,(H,8,9)
InChI Key	DYUMBFTYRJMAFK-UHFFFAOYSA-N
MDL Number	MFCD00661865
Molecular Formula	C6H4N2O
Molecular Weight	120.1088
SMILES	N#CC1=CC=CNC1=O
Synonyms	3-cyano-2-pyridone, 3-Cyano-2-hydroxypyridine, 20577-27-9, 2-Hydroxynicotinonitrile, 2-Hydroxy-3-cyanopyridine, 2-Hydroxypyridine-3-carbonitrile, 95907-03-2, 1,2-DIHYDRO-2-OXOPYRIDINE-3-CARBONITRILE, 5657-63-6, 2-oxo-1,2-dihydropyridine-3-carbonitrile, 2-oxo-1H-pyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 1,2-dihydro-2-oxo-, 3-CYANO-2(1H)-PYRIDINONE, CHEMBL2314370, DYUMBFTYRJMAFK-UHFFFAOYSA-N, MFCD07363805, cyanopyridone, cyano-pyridone, PubChem6539, PubChem20421, AC1Q6GOW, 2-Hydroxynicotin onitrile, oxo-3-pyridinecarbonitrile, 2-Hydroxynicotinonitrile #, ACMC-209fc3, 3-Cyano-2(1H)-pyridone, AC1Q4Q8L, 3-CYANO-2-PYRIDONE, 3-Cyanopyridin-2(1H)-one, KSC494I9D, SCHEMBL490790, AC1LB727, CTK3J4491, 1,2-dihydro-2-oxonicotinonitrile, ACT04540, ALBB-020186, KS-000003DZ, 3-Cyano-2-oxo-1,2-dihydropyridine, ANW-24145, ANW-51440, BBL102924, BDBM50425962, CH-446, CL0099, MFCD00661865, SBB065243, STL556733, WT1308, ZINC12471465, AKOS000164099, AKOS004910826, AC-9404, AS-8431, CS-W002655, LS20339, MCULE-3971639231, NE59866, PB21004, PS-4156, RL06066, RP00662, RTC-060774, SB10364, VP13627, 3-Cyano-2(1H)-pyridinone, AldrichCPR, AC-23035, AJ-62305, AK-28516, BR-28516, CJ-14071, SY003014, 2-oxo-1,2-dihydro-3-pyridinecarbonitrile, 1,2-Dihydro-2-oxo-pyridine-3-carbonitrile, 2-Oxo-1,2-dihydro-pyridine-3-carbonitrile, 20577-27-9 2-Hydroxy-3-cyanopyridine, 3-PYRIDINECARBONITRILE, 2-HYDROXY-, AB0023303, AB1001501, DB-080364, TC-060774, 4CH-006158, AM20050933, FT-0650437, FT-0651807, FT-0691713, W4330, EN300-36887, S-2068, MFCD00661865 (97+%), 577D279, 577H279, AQ-917/41144544, I02-0264, I02-1436, J-509683, W-201794, F8889-4542, Z969559768, null, C6H4N2O, 2-OXO-3-PYRIDINECARBONITRILE, AR-1E2724, CID577543, ZINC02029330, ACN-048822, A4473, 68612-94-2, 97792-42-2,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	120.032g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	120.111g/mol
Monoisotopic Mass	120.032g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number