AG00GRC9

936841-70-2 | 3-Bromo-4-Trifluoromethylpyridine

AG00GRC9

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CAS Number	936841-70-2
Catalog Number	AG00GRC9(AGN-PC-02PSB6)
Chemical Name	3-Bromo-4-Trifluoromethylpyridine
IUPAC Name	3-bromo-4-(trifluoromethyl)pyridine
InChI	InChI=1S/C6H3BrF3N/c7-5-3-11-2-1-4(5)6(8,9)10/h1-3H
InChI Key	OPNNLECPNPMTMV-UHFFFAOYSA-N
MDL Number	MFCD08061310
Molecular Formula	C6H3BrF3N
Molecular Weight	225.9939
SMILES	FC(C1=C(Br)C=NC=C1)(F)F
Synonyms	3-Bromo-4-(trifluoromethyl)pyridine, 936841-70-2, 3-Bromo-4-trifluoromethylpyridine, 3-BROMO-4-TRIFLUOROMETHYL-PYRIDINE, MFCD08061310, 3-bromo-4-(trifluoromethyl)-Pyridine, PubChem20392, SCHEMBL359606, CTK3I6518, DTXSID70601427, OPNNLECPNPMTMV-UHFFFAOYSA-N, 3-Bromo-4-trifluoromethyl pyridine, ABBYPHARMA AP-11-5536, ACT06701, BCP14357, KS-000011MX, 4-(trifluoromethyl)-3-bromopyridine, BBL100894, SBB096899, STL554688, ZINC16159521, AKOS005145640, AB43287, CB-2024, CM14445, PS-6833, RTC-020801, Pyridine, 3-bromo-4-(trifluoromethyl)-, AC-23346, AN-26215, BC004552, SC-20661, AB0020472, DB-002500, TC-020801, BB 0261032, FT-0658827, ST24041863, V1350, X-4561, I02-1556, Q-101481, C6H3BrF3N, ACN-056532, A11031,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.94g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	225.996g/mol
Monoisotopic Mass	224.94g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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