AG002RXL

261635-74-9 | 4-Methyl-6-(trifluoromethyl)nicotinic acid

AG002RXL

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CAS Number	261635-74-9
Catalog Number	AG002RXL(AGN-PC-02109L)
Chemical Name	4-Methyl-6-(trifluoromethyl)nicotinic acid
IUPAC Name	4-methyl-6-(trifluoromethyl)pyridine-3-carboxylic acid
InChI	InChI=1S/C8H6F3NO2/c1-4-2-6(8(9,10)11)12-3-5(4)7(13)14/h2-3H,1H3,(H,13,14)
InChI Key	IJZZCZADLDCJRX-UHFFFAOYSA-N
MDL Number	MFCD11848202
Molecular Formula	C8H6F3NO2
Molecular Weight	205.1339
SMILES	O=C(O)C1=CN=C(C(F)(F)F)C=C1C
Synonyms	261635-74-9, 4-methyl-6-(trifluoromethyl)nicotinic acid, 4-METHYL-6-TRIFLUOROMETHYL-NICOTINIC ACID, 4-Methyl-6-trifluoromethylnicotinic acid, 6-(Trifluoromethyl)-4-methylpyridine-3-carboxylic acid, 4-METHYL-6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXYLIC ACID, MFCD11848202, SCHEMBL6215528, CTK1A0555, DTXSID50595956, ZINC40448474, AKOS022174701, FCH1406691, ACM261635749, QC-10956, SC-29632, AJ-102758, AX8098954, DB-067543, FT-0648512, 3-Pyridinecarboxylicacid, 4-methyl-6-(trifluoromethyl)-,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.035g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.136g/mol
Monoisotopic Mass	205.035g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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

Lot Number