AG008OTK

74853-66-0 | 2,2,2-Trifluoro-1-(4-(trifluoromethyl)phenyl)ethanone

AG008OTK

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CAS Number	74853-66-0
Catalog Number	AG008OTK(AGN-PC-0JMU2D)
Chemical Name	2,2,2-Trifluoro-1-(4-(trifluoromethyl)phenyl)ethanone
IUPAC Name	2,2,2-trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone
InChI	InChI=1S/C9H4F6O/c10-8(11,12)6-3-1-5(2-4-6)7(16)9(13,14)15/h1-4H
InChI Key	ZERSWRKHUIMRSN-UHFFFAOYSA-N
MDL Number	MFCD00061276
Molecular Formula	C9H4F6O
Molecular Weight	242.1179
SMILES	FC(C1=CC=C(C(C(F)(F)F)=O)C=C1)(F)F
Synonyms	74853-66-0, 2,2,2-Trifluoro-1-(4-(trifluoromethyl)phenyl)ethanone, 4-(Trifluoromethyl)-alpha,alpha,alpha-trifluoroacetophenone, 2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone, 2,2,2-Trifluoro-4'-(trifluoromethyl)acetophenone, ZERSWRKHUIMRSN-UHFFFAOYSA-N, Ethanone, 2,2,2-trifluoro-1-[4-(trifluoromethyl)phenyl]-, 4-Trifluoromethyl-.alpha.,.alpha.,.alpha.-trifluoroacetophenone, 2,2,2-trifluoro-1-(4-(trifluoromethyl)phenyl)ethan-1-one, 2,2,2-trifluoro-1-[4-(trifluoromethyl)phenyl]ethan-1-one, AC1L3PQ3, SCHEMBL1078685, CTK5E0583, DTXSID20225819, ZINC4290221, ZX-AP004085, 1636AC, ANW-73420, KM1646, MFCD00061276, PC4353, SBB099541, 4-Trifluoroacetyltrifluoromethylbenzene, AKOS005259710, AJ-50307, CC-16991, PS-11192, AX8011452, TC-162165, FT-0609031, 4-(Trifluoromethyl)-A,A,A-trifluoroacetophenone, A838243, C-14557, 2,2,2-Trifluoro-1-(4-trifluoromethylphenyl)ethanone, 2,2,2-Trifluoro-4'-(trifluoromethyl)acetophenone, 97%, 4-Trifluoromethyl-alpha,alpha,alpha-trifluoroacetophenone, 2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone #, 4'-(Trifluoromethyl)-alpha,alpha,alpha-trifluoroacetophenone, 4'-Trifluoromethyl-alpha,alpha,alpha-trifluoroacetophenone, Ethanone,2,2,2-trifluoro-1-[4-(trifluoromethyl)phenyl]-, 2,2,2-tris(fluoranyl)-1-[4-(trifluoromethyl)phenyl]ethanone, C9H4F6O, CID144683, ZINC04290221, 4- -ALPHA,ALPHA,ALPHA-TRIFLUOROACETOPHENONE, 4-(Trifluoromethyl)-alpha,alpha,alpha-trifluoroaecetophenone, 98% - 1G 1g,

Complexity	258
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.017g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	242.12g/mol
Monoisotopic Mass	242.017g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1224

Certificate of Analysis

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