AG003J0E

1031929-01-7 | 3-Bromo-2-fluoro-5-(trifluoromethyl)pyridine

AG003J0E

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CAS Number	1031929-01-7
Catalog Number	AG003J0E(AGN-PC-03XYNM)
Chemical Name	3-Bromo-2-fluoro-5-(trifluoromethyl)pyridine
IUPAC Name	3-bromo-2-fluoro-5-(trifluoromethyl)pyridine
InChI	InChI=1S/C6H2BrF4N/c7-4-1-3(6(9,10)11)2-12-5(4)8/h1-2H
InChI Key	HKACHYLUXHBYMO-UHFFFAOYSA-N
MDL Number	MFCD08061304
Molecular Formula	C6H2BrF4N
Molecular Weight	243.9844
SMILES	FC(C1=CN=C(F)C(Br)=C1)(F)F
Synonyms	3-BROMO-2-FLUORO-5-(TRIFLUOROMETHYL)PYRIDINE, 1031929-01-7, 2-Fluoro-3-bromo-5-trifluoromethylpyridine, 3-bromo-2-fluoro-5-(trifluoromethyl)ryridine, MFCD08061304, PYRIDINE, 3-BROMO-2-FLUORO-5-(TRIFLUOROMETHYL)-, W-204492, PubChem15149, SCHEMBL1336778, CTK0G9290, ZX-AP010070, BBL101165, PC3862, SBB099773, STL554961, ZINC16159025, AKOS005257067, AF10182, AN-2128, FCH1386282, RP05945, TRA0043338, VP11171, AC-24941, AJ-68624, AK113115, BC003977, AB0039407, AB1007012, AX8165150, DB-003918, TC-010975, FT-0659723, Y6866, X-4210, Pyridine,3-bromo-2-fluoro-5-(trifluoromethyl)-, 3-Bromo-2-fluoro-5-(trifluoromethyl)pyridine, 97%, I02-1642, J-511857, null, C6H2BrF4N, A1852,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.931g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	243.987g/mol
Monoisotopic Mass	242.931g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3(6.1)
Hazard statements	H226-H301-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P310-P305+P351+P338
UN Code	UN 1992

Certificate of Analysis

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