AG003FFA

243459-93-0 | 1-(2,3,5-Trifluorophenyl)ethanone

AG003FFA

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CAS Number	243459-93-0
Catalog Number	AG003FFA(AGN-PC-0KKXUV)
Chemical Name	1-(2,3,5-Trifluorophenyl)ethanone
IUPAC Name	1-(2,3,5-trifluorophenyl)ethanone
InChI	InChI=1S/C8H5F3O/c1-4(12)6-2-5(9)3-7(10)8(6)11/h2-3H,1H3
InChI Key	ZCVPTIVXINDYGY-UHFFFAOYSA-N
MDL Number	MFCD00083548
Molecular Formula	C8H5F3O
Molecular Weight	174.1199
SMILES	CC(C1=CC(F)=CC(F)=C1F)=O
Synonyms	243459-93-0, 1-(2,3,5-trifluorophenyl)ethanone, 2',3',5'-Trifluoroacetophenone, 2,3,5-Trifluoroacetophenone, 1-(2,3,5-Trifluorophenyl)ethan-1-one, Ethanone, 1-(2,3,5-trifluorophenyl)-, MFCD00083548, PubChem4283, AC1MCRBB, Intermediates-ZCF02658, KSC553I4P, SCHEMBL363749, CTK4F3447, KS-00000ZVB, DTXSID20380290, ZCVPTIVXINDYGY-UHFFFAOYSA-N, 1-acetyl-2,3,5-trifluorobenzene, ACT00420, ZINC2575074, ANW-46320, SBB064380, AKOS015890081, AC-3624, AM61864, AS04014, CM11231, JS-4125, TRA0041824, Ethanone,1-(2,3,5-trifluorophenyl)-, AJ-42329, AN-12754, CJ-10063, RT-006606, ST2403059, FT-0653477, W4789, A19687, K-6532, 459T930, I01-4736, C8H5F3O, ZINC02575074, CID2776905, 2'',3'',5''-TRIFLUOROACETOPHENONE,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.122g/mol
Monoisotopic Mass	174.029g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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