AG003KUM

749932-17-0 | 4-BROMO-1-DIFLUOROMETHYL-2-FLUOROBENZENE

AG003KUM

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CAS Number	749932-17-0
Catalog Number	AG003KUM(AGN-PC-0WALDP)
Chemical Name	4-BROMO-1-DIFLUOROMETHYL-2-FLUOROBENZENE
IUPAC Name	4-bromo-1-(difluoromethyl)-2-fluorobenzene
InChI	InChI=1S/C7H4BrF3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,7H
InChI Key	WRTTUKLMUOEXBS-UHFFFAOYSA-N
MDL Number	MFCD06657963
Molecular Formula	C7H4BrF3
Molecular Weight	225.0059
SMILES	FC1=CC(Br)=CC=C1C(F)F
Synonyms	4-bromo-1-(difluoromethyl)-2-fluorobenzene, 749932-17-0, 4-Bromo-1-difluoromethyl-2-fluorobenzene, ACMC-20amo9, AC1MC4D8, SCHEMBL248377, 4-Bromo-2-fluorobenzal fluoride, CTK5E0865, DTXSID40375608, WRTTUKLMUOEXBS-UHFFFAOYSA-N, ZX-AP010384, 9176AE, BBL103523, MFCD06657963, STL557333, ZINC59796820, AKOS005256032, 4-Bromo-alpha,alpha,2-trifluorotoluene, FCH1379275, PC49172, RTR-024185, 2-fluoro-4-bromo-difluoromethyl benzene, AS-45883, TR-024185, FT-0678871, C-6110, 4-Bromo-1-(difluoromethyl)-2-fluorobenzene, 97%, A838300, I01-12821, 1-[bis(fluoranyl)methyl]-4-bromanyl-2-fluoranyl-benzene, 4-Bromo-1-difluoromethyl-2-fluorobenzene Stabilized over Potassium carbonate, C7H4BrF3, CID2761182, 4-bromo-1-(difluoromethyl)-2-fluoro-benzene,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.945g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	225.008g/mol
Monoisotopic Mass	223.945g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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