AG003KMH

87674-21-3 | 1-(3-Fluoropyridin-4-yl)ethanone

AG003KMH

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CAS Number	87674-21-3
Catalog Number	AG003KMH(AGN-PC-00L1OD)
Chemical Name	1-(3-Fluoropyridin-4-yl)ethanone
IUPAC Name	1-(3-fluoropyridin-4-yl)ethanone
InChI	InChI=1S/C7H6FNO/c1-5(10)6-2-3-9-4-7(6)8/h2-4H,1H3
InChI Key	PPULDLJGJZUOBS-UHFFFAOYSA-N
MDL Number	MFCD07375077
Molecular Formula	C7H6FNO
Molecular Weight	139.1270
SMILES	FC1=C(C=CN=C1)C(C)=O
Synonyms	1-(3-Fluoropyridin-4-yl)ethanone, 87674-21-3, 4-ACETYL-3-FLUOROPYRIDINE, 1-(3-fluoropyridin-4-yl)ethan-1-one, Ethanone,1-(3-fluoro-4-pyridinyl)-(9ci), ETHANONE, 1-(3-FLUORO-4-PYRIDINYL)-, 3-fluoro-4-acetylpyridine, 3-fluoro-4-acetyl pyridine, SCHEMBL459712, CTK8B5688, DTXSID60520592, PPULDLJGJZUOBS-UHFFFAOYSA-N, 1-(3-Fluoro-4-pyridinyl)ethanone, KS-00000C2E, ANW-49611, MFCD07375077, ZINC39068958, AKOS006285607, CS-W021221, MCULE-7778949077, PB22036, QC-4755, RP20521, TRA0010887, AJ-97915, AK-37142, BR-37142, CJ-19702, DS-13177, SC-48233, SY011662, AB0027196, ST2408556, TC-138356, 4CH-012287, AM20061573, FT-0694270, W9003, S-7040, MFCD07375077 (97+%), J-503147, C7H6FNO, Ethanone, 1-(3-fluoro-4-pyridinyl)- (9CI),

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	0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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