AG004N8S

87407-12-3 | 3-Trifluoromethylpicolinic acid

AG004N8S

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CAS Number	87407-12-3
Catalog Number	AG004N8S(AGN-PC-00LLTU)
Chemical Name	3-Trifluoromethylpicolinic acid
IUPAC Name	3-(trifluoromethyl)pyridine-2-carboxylic acid
InChI	InChI=1S/C7H4F3NO2/c8-7(9,10)4-2-1-3-11-5(4)6(12)13/h1-3H,(H,12,13)
InChI Key	DMWLBOPLZYJGPT-UHFFFAOYSA-N
MDL Number	MFCD07375386
Molecular Formula	C7H4F3NO2
Molecular Weight	191.1074
SMILES	FC(C1=CC=CN=C1C(=O)O)(F)F
Synonyms	87407-12-3, 3-(Trifluoromethyl)pyridine-2-carboxylic Acid, 3-(Trifluoromethyl)picolinic acid, 3-(trifluoromethyl)-2-pyridinecarboxylic acid, 3-Trifluoromethylpicolinic acid, 3-Trifluoromethylpyridine-2-carboxylic acid, 2-Pyridinecarboxylic acid, 3-(trifluoromethyl)-, 3-(Trifluoromethy)pyridine-2-carboxylic acid, MFCD07375386, 3-(Trifluoromethy)pyridine-2-carboxylic acid, 97%, 87407-12-3 3-(Trifluoromethyl)pyridine-2-carboxylic acid, ACMC-209qkb, KSC447O0J, SCHEMBL286833, trifluoromethyl-2-picolinic acid, CTK3E7704, DTXSID70530647, DMWLBOPLZYJGPT-UHFFFAOYSA-N, ABBYPHARMA AP-18-5219, KS-000011HW, ANW-38697, BBL102311, CT-502, HT1077, SBB053032, STL556110, WT1935, ZINC12336826, AKOS005064018, AB41844, AC-3039, CS-W003406, LF10538, MCULE-1252398765, NA-0812, QC-7583, RP03763, RTR-027353, VP11270, WT81924, AJ-61113, AK-36643, AN-13354, BR-36643, SC-14593, SY003642, AB0004453, AB1001678, DB-031395, ST2417427, TR-027353, 3-trifluoromethyl-2-pyridine carboxylic acid, 3-Trifluoromethyl-pyridine-2-carboxylic acid, 4CH-000924, AM20061566, FT-0654185, X4384, 3-(TRIFLUOROMETHYL)-2-PICOLINIC ACID, MFCD07375386 (97%), 2-Pyridinecarboxylicacid, 3-(trifluoromethyl)-, 3-(trifluoromethyl)-pyridine-2-carboxylic acid, A-2656, 407T123, A842127, 3-(Trifluoromethyl)pyridine-2-carboxylic acid, 97%, I01-2285, J-511033, null, 3- pyridine-2-carboxylicacid, C7H4F3NO2, ACN-031617, T3155, 3-(Trifluoromethyl)pyridine-2-carboxylic acid, 97% 250mg,

Complexity	204
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.019g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	191.109g/mol
Monoisotopic Mass	191.019g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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