AG003LDX

184970-26-1 | 4-(bromomethyl)-1-fluoro-2-(trifluoromethyl)benzene

AG003LDX

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CAS Number	184970-26-1
Catalog Number	AG003LDX(AGN-PC-079N0F)
Chemical Name	4-(bromomethyl)-1-fluoro-2-(trifluoromethyl)benzene
IUPAC Name	4-(bromomethyl)-1-fluoro-2-(trifluoromethyl)benzene
InChI	InChI=1S/C8H5BrF4/c9-4-5-1-2-7(10)6(3-5)8(11,12)13/h1-3H,4H2
InChI Key	JVQDTRQMKZMBAU-UHFFFAOYSA-N
MDL Number	MFCD00061177
Molecular Formula	C8H5BrF4
Molecular Weight	257.0229
SMILES	FC(C1=CC(CBr)=CC=C1F)(F)F
Synonyms	184970-26-1, 4-Fluoro-3-(trifluoromethyl)benzyl bromide, 4-(bromomethyl)-1-fluoro-2-(trifluoromethyl)benzene, 4-fluoro-3-trifluoromethylbenzyl bromide, MFCD00061177, ALPHA-BROMO-4-FLUORO-3-(TRIFLUOROMETHYL)TOLUENE, 3-(TRIFLUOROMETHYL)-4-FLUOROBENZYL BROMIDE, Benzene, 4-(bromomethyl)-1-fluoro-2-(trifluoromethyl)-, PubChem4650, AC1MC7IP, ACMC-1C8R0, KSC495O4F, SCHEMBL118433, CTK3J5742, DTXSID40372157, JVQDTRQMKZMBAU-UHFFFAOYSA-N, ACT13246, JRD-0566, ZINC2600094, ANW-23218, SBB070885, WT1831, AKOS005255370, 4-fluoro-3-trifluoromethylbenzylbromide, AC-9749, AM62183, PF10808, PS-9948, QC-7668, RTC-062403, TRA0071906, VZ29017, 4-fluoro-3-(trifluoromethyl)benzylbromide, 4-fluoro-3-trifluoromethyl benzyl bromide, AJ-44058, BC002795, SC-01957, AB0010188, DB-023788, TC-062403, 4CH-006838, FT-0618473, ST24028793, 4-bromomethyl-1-fluoro-2-trifluoromethylbenzene, A22524, B-7540, 1-bromomethyl-4-fluoro-3-trifluoromethyl-benzene, 4-Bromomethyl-1-fluoro-2-trifluoromethyl-benzene, 4-Fluoro-3-(trifluoromethyl)benzyl bromide 98%, I01-4666, 184970-26-1 4-fluoro-3-trifluoromethylbenzyl bromide, 4-Fluoro-3-(trifluoromethyl)benzyl bromide, AldrichCPR, a-bromo-4-fluoro-3-(trifluoromethyl)toluene;4-Bromomethyl-1-fluoro-2-trifluoromethyl-benzene, C8H5BrF4, CID2737577,

Complexity	168
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	255.951g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	257.026g/mol
Monoisotopic Mass	255.951g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 1760

Certificate of Analysis

Lot Number