AG00D86J

436799-33-6 | 3-Bromo-5-(trifluoromethyl)pyridine

AG00D86J

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CAS Number	436799-33-6
Catalog Number	AG00D86J(AGN-PC-0NGCBE)
Chemical Name	3-Bromo-5-(trifluoromethyl)pyridine
IUPAC Name	3-bromo-5-(trifluoromethyl)pyridine
InChI	InChI=1S/C6H3BrF3N/c7-5-1-4(2-11-3-5)6(8,9)10/h1-3H
InChI Key	HEDHNDVPKRVQPN-UHFFFAOYSA-N
MDL Number	MFCD04972700
Molecular Formula	C6H3BrF3N
Molecular Weight	225.9939
SMILES	BrC1=CC(=CN=C1)C(F)(F)F
Synonyms	3-Bromo-5-(trifluoromethyl)pyridine, 436799-33-6, 3-bromo-5-trifluoromethyl-pyridine, 3-bromo-5-trifluoromethylpyridine, 5-bromo-3-(trifluoromethyl)pyridine, MFCD04972700, Pyridine, 3-bromo-5-(trifluoromethyl)-, ABBYPHARMA AP-11-5533, AK-35160, 3-Bromo-5-(trifluoromethyl)pyridine, 97%, 3-BROMO-5-(TRIFLUORMETHYL)-PYRIDINE, Q-101484, 3-Trifluoromethyl-5-bromopyridine, PubChem3010, ACMC-209jv5, SCHEMBL185547, 3-bromo-5-trifluoromethylpyridin, CTK4I7651, DTXSID50456230, HEDHNDVPKRVQPN-UHFFFAOYSA-N, ACT01583, KS-00000K4C, ZINC8700996, ZX-AP002558, ANW-30015, BBL102933, PC1078, SBB054386, STL556742, 3-Bromo-5- (trifluoromethyl)pyridine, AKOS005063455, AS04719, CB-2515, CS-W007687, FCH1325743, LF10387, MCULE-2654705555, PB32382, PS-6390, Pyridine,3-bromo-5-(trifluoromethyl)-, QC-7607, RP27628, RTR-016945, TRA0065178, AC-23349, ACM436799336, AJ-58528, AN-28344, BC002384, BR-35160, CJ-13510, SC-47928, SY013774, AB0009834, AX8028737, ST2417550, TL8003063, 4CH-013000, A6998, AM20070189, FT-0650545, ST51042315, MFCD04972700 (98%), A-2967, 841B702, I02-1400, 3-Bromo-5- pyridine, C6H3BrF3N, ACN-052101, CID11127991, B4710, (1-(5-CARBOXYPENTYL)-3,3-DIMETHYL-3H-INDOL-1-IUM-2-YL)METHANIDE HYDROBROMIDE, 936841-70-2,

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	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

Lot Number