AG000PPR

1198171-18-4 | Benzene, 1-bromo-2-(difluoromethyl)-4-fluoro-

AG000PPR

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CAS Number	1198171-18-4
Catalog Number	AG000PPR(AGN-PC-0WBR9S)
Chemical Name	Benzene, 1-bromo-2-(difluoromethyl)-4-fluoro-
IUPAC Name	1-bromo-2-(difluoromethyl)-4-fluorobenzene
InChI	InChI=1S/C7H4BrF3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,7H
InChI Key	XCLIWLPXTOXVAA-UHFFFAOYSA-N
MDL Number	MFCD14698532
Molecular Formula	C7H4BrF3
Molecular Weight	225.0059
SMILES	FC(F)C1=C(Br)C=CC(F)=C1
Synonyms	1-BROMO-2-(DIFLUOROMETHYL)-4-FLUOROBENZENE, 1198171-18-4, SCHEMBL1420082, CTK4B1515, DTXSID60673310, XCLIWLPXTOXVAA-UHFFFAOYSA-N, 3420AA, ANW-55374, MFCD14698532, ZINC66309143, AKOS005258397, FCH1387135, 1-Bromo-2-difluoromethyl-4-fluorobenzene, AK-67558, AS-43271, AJ-115836, AX8208120, TR-034383, FT-0681877, Y-9597, Benzene, 1-bromo-2-(difluoromethyl)-4-fluoro-, I01-12713, 1-Bromo-2-difluoromethyl-4-fluorobenzene stabilized over potassium carbonate, C7H4BrF3, 1-Bromo-2-difluoromethyl-4-fluoro-b,

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	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number