AG003LDZ

537050-14-9 | 4-Fluoro-3-(Trifluoromethyl)Phenacyl Bromid

AG003LDZ

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CAS Number	537050-14-9
Catalog Number	AG003LDZ(AGN-PC-0KKZ4O)
Chemical Name	4-Fluoro-3-(Trifluoromethyl)Phenacyl Bromid
IUPAC Name	2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone
InChI	InChI=1S/C9H5BrF4O/c10-4-8(15)5-1-2-7(11)6(3-5)9(12,13)14/h1-3H,4H2
InChI Key	BUNOSKWLVXNWEH-UHFFFAOYSA-N
MDL Number	MFCD03094509
Molecular Formula	C9H5BrF4O
Molecular Weight	285.0330
SMILES	O=C(C1=CC=C(F)C(C(F)(F)F)=C1)CBr
Synonyms	537050-14-9, 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMIDE, 2-bromo-1-(4-fluoro-3-(trifluoromethyl)phenyl)ethanone, 4-Fluoro-3-(trifluoromethyl)phenacylbromid, 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone, 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMID, 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethan-1-one, 2-Bromo-4'-fluoro-3'-(trifluoromethyl)acetophenone, 4-Fluoro-3-(trifluoromethyl)phenacylbromide, 2-BROMO-4'-FLUORO-3'-TRIFLUOROMETHYLACETOPHENONE, ACMC-209l9v, AC1MCU24, SCHEMBL129133, CTK4J8653, DTXSID50381134, BUNOSKWLVXNWEH-UHFFFAOYSA-N, BCP27087, KS-00000C2T, ZINC2243367, ANW-31841, BBL104123, CL8633, MFCD03094509, SBB068929, STL557938, AKOS005063989, AS04036, AS05115, CB-3259, CM11151, DS-1523, RP06674, TRA0092498, AC-23472, AJ-34311, AK-37841, AN-27923, BR-37841, CJ-08023, SY013120, AB0025357, DB-011972, ST2409611, TR-019002, B5213, FT-0083742, FT-0651567, W6806, 4-Fluoro-3-(trifluoromethyl)-phenacyl bromide, MFCD03094509 (97%), S-1964, J-515361, S01-0650, 2-BROMO-4-FLUORO-3-TRIFLUOROMETHYLACETOPHENONE, 2-bromo-1-(4-fluoro-3-trifluoromethyl-phenyl)-ethanone, 4'-FLUORO-3'-(TRIFLUOROMETHYL)-PHENACYLBROMIDE, 4-Fluoro-3-(trifluoromethyl)phenacyl bromide, AldrichCPR, 2-bromo-1-[4-fluoro-3(trifluoromethyl)phenyl]-1-ethanone, C9H5BrF4O, 4-FLUORO-3- PHENACYLBROMID, ACN-040360, CID2778787, A7814,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.946g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	285.036g/mol
Monoisotopic Mass	283.946g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number