AG004XQY

84331-14-6 | 1-(6-Fluoropyridin-3-yl)ethanone

AG004XQY

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CAS Number	84331-14-6
Catalog Number	AG004XQY(AGN-PC-00KUEF)
Chemical Name	1-(6-Fluoropyridin-3-yl)ethanone
IUPAC Name	1-(6-fluoropyridin-3-yl)ethanone
InChI	InChI=1S/C7H6FNO/c1-5(10)6-2-3-7(8)9-4-6/h2-4H,1H3
InChI Key	BQQPPKSWFCUWCN-UHFFFAOYSA-N
MDL Number	MFCD07375076
Molecular Formula	C7H6FNO
Molecular Weight	139.1270
SMILES	CC(C1=CC=C(F)N=C1)=O
Synonyms	1-(6-fluoropyridin-3-yl)ethanone, 84331-14-6, 5-Acetyl-2-fluoropyridine, 1-(6-FLUOROPYRIDIN-3-YL)ETHAN-1-ONE, AK-29672, ETHANONE, 1-(6-FLUORO-3-PYRIDINYL)-, 5-Acethyl-2-fluoropyridine, SCHEMBL2566447, CTK8C0116, KS-00000JTT, DTXSID90517899, 1-(6-Fluoro-3-pyridyl)ethanone, BQQPPKSWFCUWCN-UHFFFAOYSA-N, 1-(6-Fluoro-3-pyridinyl)ethanone, ZX-RL005069, 1-(6-Fluoropyridine-3-yl)ethanone, ANW-64148, FCH855993, MFCD07375076, ZINC39068961, AKOS006285606, AB41115, CS-W003402, QC-6997, AJ-97916, BR-29672, CJ-19703, DS-11248, EN001116, PC404005, SC-34866, SY022263, AB0026941, AB1010421, AX8024425, DB-076022, ST2408593, TC-152893, 4CH-012312, FT-0725074, W8700, J3.602.427E, MFCD07375076 (95%), S-6636, Ethanone,1- -, C7H6FNO,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	139.043g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	139.129g/mol
Monoisotopic Mass	139.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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