AG000UUO

130723-13-6 | Benzene, 1-bromo-3-fluoro-5-(trifluoromethyl)-

AG000UUO

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CAS Number	130723-13-6
Catalog Number	AG000UUO(AGN-PC-0KK7QO)
Chemical Name	Benzene, 1-bromo-3-fluoro-5-(trifluoromethyl)-
IUPAC Name	1-bromo-3-fluoro-5-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3BrF4/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H
InChI Key	LIGBGEJPUQBLTG-UHFFFAOYSA-N
MDL Number	MFCD00042498
Molecular Formula	C7H3BrF4
Molecular Weight	242.9963
SMILES	C(F)(F)(F)c1cc(Br)cc(c1)F
Synonyms	3-Bromo-5-fluorobenzotrifluoride, 130723-13-6, 1-Bromo-3-fluoro-5-(trifluoromethyl)benzene, 3-bromo-5-fluorotrifluoromethylbenzene, 3-Fluoro-5-(trifluoromethyl)bromobenzene, 3-fluoro-5-trifluoromethylbromobenzene, 5-fluoro-3-bromobenzotrifluoride, MFCD00042498, 1-bromo-3-fluoro-5-trifluoromethyl benzene, 3-Bromo-alpha,alpha,alpha,5-tetrafluorotoluene, LIGBGEJPUQBLTG-UHFFFAOYSA-N, Benzene, 1-bromo-3-fluoro-5-(trifluoromethyl)-, 3-bromo-5-fluoro-trifluoromethylbenzene, 3-Bromo-5-fluorobenzotrifluoride, 97%, PubChem1640, AC1MC5BU, SCHEMBL43363, CTK7B7951, KS-00000EZR, DTXSID50371277, 5-bromo-3-fluorobenzo trifluoride, ACT13091, EBD41372, ZINC2584345, BBL102991, CL8621, SBB099656, STL556800, AKOS005258441, AC-4114, AN-1811, AS01733, NF10062, VZ26473, 3-FLUORO-5-BROMOBENZOTRIFLUORIDE, 3-Fluoro-5-trifluoromethyl-bromobenzene, 3-fluoro-5-trifluoromethyl-bromo-benzene, 3-fluoro-5-trifluoromethylphenyl bromide, AJ-43415, AK-33099, BC002197, BR-33099, DS-12431, SC-00753, SY018353, 1-bromo-3-fluoro-5-trifluoromethylbenzene, AB0012728, TL8000731, 3-bromo-5-fluoro-1-(trifluoromethyl)benzene, 5-bromo-3-fluoro-1-(trifluoromethyl)benzene, AM20060134, B3106, BB 0262932, FT-0615177, ST24032203, ST50408585, 1-bromo-3-fluoro-5-(trifluoromethyl)-benzene, A-3300, MFCD00042498 (97+%), I01-2210, J-512015, C7H3BrF4, ACN-050575, CID2736323, 3-Bromo-5-fluorobenzotrifluoride, 97% - 1G 1g,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.935g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	242.999g/mol
Monoisotopic Mass	241.935g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

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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