AG0014SE

1214330-74-1 | 2-Pyridinecarboxylic acid, 3-methoxy-6-(trifluoromethyl)-

AG0014SE

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CAS Number	1214330-74-1
Catalog Number	AG0014SE(AGN-PC-0WAMYF)
Chemical Name	2-Pyridinecarboxylic acid, 3-methoxy-6-(trifluoromethyl)-
IUPAC Name	3-methoxy-6-(trifluoromethyl)pyridine-2-carboxylic acid
InChI	InChI=1S/C8H6F3NO3/c1-15-4-2-3-5(8(9,10)11)12-6(4)7(13)14/h2-3H,1H3,(H,13,14)
InChI Key	DNIWSOTWTRSLCX-UHFFFAOYSA-N
MDL Number	MFCD15478069
Molecular Formula	C8H6F3NO3
Molecular Weight	221.1333
SMILES	O=C(O)C1=NC(C(F)(F)F)=CC=C1OC
Synonyms	3-Methoxy-6-(trifluoromethyl)picolinic acid, 1214330-74-1, 3-methoxy-6-(trifluoromethyl)pyridine-2-carboxylic acid, AK130160, DTXSID40673555, MFCD15478069, ZINC47218648, AKOS016013937, DS-6603, AJ-110833, AX8246452, 2-Pyridinecarboxylic acid, 3-methoxy-6-(trifluoromethyl)-, 3-Methoxy-6-(trifluoromethyl)picolinicacid,

Complexity	244
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.03g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.135g/mol
Monoisotopic Mass	221.03g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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