AG003MHE

364-12-5 | 5-Bromo-2-iodobenzotrifluoride

AG003MHE

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CAS Number	364-12-5
Catalog Number	AG003MHE(AGN-PC-0RC7IF)
Chemical Name	5-Bromo-2-iodobenzotrifluoride
IUPAC Name	4-bromo-1-iodo-2-(trifluoromethyl)benzene
InChI	InChI=1S/C7H3BrF3I/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3H
InChI Key	FTIZUXGKTNJZEG-UHFFFAOYSA-N
MDL Number	MFCD00672935
Molecular Formula	C7H3BrF3I
Molecular Weight	350.9024
SMILES	FC(F)(F)C1=C(I)C=CC(Br)=C1
Synonyms	5-Bromo-2-iodobenzotrifluoride, 364-12-5, 4-bromo-1-iodo-2-(trifluoromethyl)benzene, BUTTPARK 50\01-78, PubChem3406, ACMC-209imf, AC1MCMW4, SCHEMBL2296362, CTK5I6678, DTXSID60378434, FTIZUXGKTNJZEG-UHFFFAOYSA-N, ACT13096, KS-00000DC6, ZINC2567815, ANW-28405, MFCD00672935, 2-IODO-5-BROMOBENZOTRIFLUORIDE, AKOS009157955, AC-4119, AM61925, AS01737, CB-2743, RTR-014921, VZ30117, AJ-41478, AK-34855, AN-12314, AS-11392, BC002460, SC-03849, SY018883, AB0009776, TR-014921, 4CH-006565, CS-0040983, FT-0620098, ST24032927, A21342, Benzene, 4-bromo-1-iodo-2-(trifluoromethyl)-, M-1132, MFCD00672935 (97+%), 4-BROMO-2-(TRIFLUOROMETHYL)-1-IODOBENZENE, I01-4803, C7H3BrF3I, CID2773397,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	349.841g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	350.905g/mol
Monoisotopic Mass	349.841g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

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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