AG0009MM

113770-88-0 | 4-Pyridinecarbonitrile, 3-fluoro-

AG0009MM

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CAS Number	113770-88-0
Catalog Number	AG0009MM(AGN-PC-03L7N4)
Chemical Name	4-Pyridinecarbonitrile, 3-fluoro-
IUPAC Name	3-fluoropyridine-4-carbonitrile
InChI	InChI=1S/C6H3FN2/c7-6-4-9-2-1-5(6)3-8/h1-2,4H
InChI Key	RFQHDTRSEWCXJP-UHFFFAOYSA-N
MDL Number	MFCD04112524
Molecular Formula	C6H3FN2
Molecular Weight	122.0998
SMILES	FC=1C=NC=CC1C#N
Synonyms	3-Fluoro-4-cyanopyridine, 113770-88-0, 3-fluoropyridine-4-carbonitrile, 3-Fluoroisonicotinonitrile, 3-FLUORO-4-CYANO-PYRIDINE, 3-Fluoro-isonicotinonitrile, 4-Pyridinecarbonitrile, 3-fluoro-, 3-fluoro-4-pyridinecarbonitrile, 4-Pyridinecarbonitrile,3-fluoro-, MFCD04112524, 4-Pyridinecarbonitrile,3-fluoro-(9CI), 4-Cyano-3-fluoropyridine, ACMC-2099k3, SCHEMBL9834946, CTK4A8429, KS-00000DVZ, DTXSID80623019, RFQHDTRSEWCXJP-UHFFFAOYSA-N, 3-fluoranylpyridine-4-carbonitrile, ANW-16657, BBL103167, SBB055633, STL556977, ZINC35635702, AKOS006292652, AM81274, CS-W003153, MCULE-7614711570, RP19448, TRA0029774, VP13528, AC-29432, AJ-91934, AK-25304, BR-25304, CJ-18812, QC-10137, SC-14953, SY023412, TS-01617, AB0004756, AB1005193, DB-016006, TC-105402, 4CH-000933, FT-0692174, ST24032627, X9068, B-6469, MFCD04112524 (97+%), A803090, I02-2096, J-512480, 4-Pyridinecarbonitrile,3-fluoro-(9CI); 4-Cyano-3-fluoropyridine, C6H3FN2, ACN-031640, 4-Pyridinecarbonitrile, 3-fluoro- (9CI),

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	122.028g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	122.102g/mol
Monoisotopic Mass	122.028g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	36.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3439

Certificate of Analysis

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