AG003LEF

400-93-1 | 4'-Fluoro-3'-nitroacetophenone

AG003LEF

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CAS Number	400-93-1
Catalog Number	AG003LEF(AGN-PC-0KK6NA)
Chemical Name	4'-Fluoro-3'-nitroacetophenone
IUPAC Name	1-(4-fluoro-3-nitrophenyl)ethanone
InChI	InChI=1S/C8H6FNO3/c1-5(11)6-2-3-7(9)8(4-6)10(12)13/h2-4H,1H3
InChI Key	PTCNZDJJIOLIKQ-UHFFFAOYSA-N
MDL Number	MFCD00115369
Molecular Formula	C8H6FNO3
Molecular Weight	183.1365
SMILES	CC(C1=CC=C(F)C([N+]([O-])=O)=C1)=O
Synonyms	4'-Fluoro-3'-nitroacetophenone, 400-93-1, 1-(4-fluoro-3-nitrophenyl)ethanone, 4-Fluoro-3-nitroacetophenone, 1-(4-fluoro-3-nitrophenyl)ethan-1-one, 4' -fluoro-3'-nitroacetophenone, 1-(4-fluoro-3-nitro-phenyl)ethanone, 4-fluoro-3'-nitroacetophenone, ETHANONE, 1-(4-FLUORO-3-NITROPHENYL)-, 4-FLUORO-3-NITROACETOPHNEONE, MFCD00115369, 3'-NITRO-4'-FLUOROACETOPHENONE, 1-acetyl-4-fluoro-3-nitrobenzene, 1-(4-fluoro-3-nitrophenyl)-ethanone, 1-(4-fluoro-3-nitro-phenyl)-ethanone, 4'-Fluoro-3'-nitroacetophenone, 98%, PubChem4238, ACMC-1CSMA, 3-Nitro-4-fluoracetophenon, AC1MC1J5, SCHEMBL9157, KSC237A6T, Jsp006938, 2-fluoro-5-acetyl-nitro benzene, CTK1D7069, DTXSID60370392, PTCNZDJJIOLIKQ-UHFFFAOYSA-N, ST021, ACT12898, ALBB-016821, KS-00000FH7, ZINC2577568, 3-NITRO-4-FLUOROACETOPHENONE, ANW-29284, BBL011191, SBB063567, STK932262, AKOS005255441, AC-3620, AS04010, CM11207, CS-W017063, LS10018, MCULE-7381759502, NF10222, RTR-016005, VZ27369, 4'-Fluoro-3'-nitroacetophenone, 97%, AJ-42667, AK-30373, AN-12821, AS-15008, BC220319, N604, SC-04244, SY019178, AB0015906, AB1010830, DB-006811, ST2410857, TR-016005, 400-93-1 3'-nitro-4'-fluoroacetophenone, A6699, AM20040387, F0777, FT-0080179, FT-0601444, ST50827294, TL80090015, C-5107, MFCD00115369 (97+%), I01-2165, J-515378, 4 inverted exclamation mark -Fluoro-3 inverted exclamation mark -nitroacetophenone, C8H6FNO3, 4/'-Fluoro-3/'-nitroacetophenone, ZINC02577568, CID2734612, 1-Fluoro-4-nitro-2-(trifluoromethyl)benzene, 5-Nitro-alpha,alpha,alpha,2-tetrafluorotoluene, 4'-Fluoro-3'-nitroacetophenone, 98% - 1G 1g,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.033g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.138g/mol
Monoisotopic Mass	183.033g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	62.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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