AG002NIJ

23516-84-9 | Ethanone, 2,2,2-trifluoro-1-(4-iodophenyl)-

AG002NIJ

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CAS Number	23516-84-9
Catalog Number	AG002NIJ(AGN-PC-0JTUBO)
Chemical Name	Ethanone, 2,2,2-trifluoro-1-(4-iodophenyl)-
IUPAC Name	2,2,2-trifluoro-1-(4-iodophenyl)ethanone
InChI	InChI=1S/C8H4F3IO/c9-8(10,11)7(13)5-1-3-6(12)4-2-5/h1-4H
InChI Key	GCWVQAKIKOQSGP-UHFFFAOYSA-N
MDL Number	MFCD02260838
Molecular Formula	C8H4F3IO
Molecular Weight	300.0164
SMILES	IC1=CC=C(C(C(F)(F)F)=O)C=C1
Synonyms	23516-84-9, 2,2,2-Trifluoro-1-(4-iodophenyl)ethanone, 2,2,2-trifluoro-1-(4-iodo-phenyl)-ethanone, 2,2,2-TRIFLUORO-1-(4-IODOPHENYL)ETHAN-1-ONE, Ethanone, 2,2,2-trifluoro-1-(4-iodophenyl)-, GCWVQAKIKOQSGP-UHFFFAOYSA-N, AC1LDBQI, C8H4F3IO, SCHEMBL3053814, CTK4F1661, DTXSID50346844, BCP06564, ZINC2579833, 1592AB, ANW-59637, MFCD02260838, AKOS015966113, AB11761, KS-00000K26, AJ-42871, AK-44315, DS-13279, TX-012876, BB 0261979, 2,2,2-Trifluoro-1-(4-iodophenyl)ethanone #, alpha,alpha,alpha-Trifluoro-4'-iodoacetophenone, Ethanone,2,2,2-trifluoro-1-(4-iodophenyl)-, Z-6328, 2,2,2-Trifluoro-1-(4-iodo-phenyl)-e thanone, 2,2,2-tris(fluoranyl)-1-(4-iodophenyl)ethanone, A816761, CID615645,

Complexity	194
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	299.926g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	300.019g/mol
Monoisotopic Mass	299.926g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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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