AG000SNO

1263377-74-7 | Benzene, 1-bromo-2,4-difluoro-3-(trifluoromethyl)-

AG000SNO

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CAS Number	1263377-74-7
Catalog Number	AG000SNO(AGN-PC-08Y0ND)
Chemical Name	Benzene, 1-bromo-2,4-difluoro-3-(trifluoromethyl)-
IUPAC Name	1-bromo-2,4-difluoro-3-(trifluoromethyl)benzene
InChI	InChI=1S/C7H2BrF5/c8-3-1-2-4(9)5(6(3)10)7(11,12)13/h1-2H
InChI Key	SUHKWEINMZXPHI-UHFFFAOYSA-N
MDL Number	MFCD18379808
Molecular Formula	C7H2BrF5
Molecular Weight	260.9868
SMILES	FC(C1=C(F)C(Br)=CC=C1F)(F)F
Synonyms	1263377-74-7, 3-Bromo-2,6-difluorobenzotrifluoride, 1-bromo-2,4-difluoro-3-(trifluoromethyl)benzene, 2,4-Difluoro-3-(trifluoromethyl)bromobenzene, MFCD18379808, BENZENE, 1-BROMO-2,4-DIFLUORO-3-(TRIFLUOROMETHYL)-, SCHEMBL16652774, SUHKWEINMZXPHI-UHFFFAOYSA-N, ZX-AP003052, ZINC67800104, AKOS024258319, AS05912, CM13201, FCH1368036, PC51187, AC-28689, AS-33174, AJ-117015, AX8228079, 1-bromo-2,4-difluro-3-(trifluoromethyl)benzene, 3-Nitro-4-fluorotrifluoromethoxybenzene, 124170-06-5,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	259.926g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	260.989g/mol
Monoisotopic Mass	259.926g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

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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