AG002RXI

261635-83-0 | 3-Pyridinecarboxylic acid, 6-chloro-2-(trifluoromethyl)-

AG002RXI

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CAS Number	261635-83-0
Catalog Number	AG002RXI(AGN-PC-0092IF)
Chemical Name	3-Pyridinecarboxylic acid, 6-chloro-2-(trifluoromethyl)-
IUPAC Name	6-chloro-2-(trifluoromethyl)pyridine-3-carboxylic acid
InChI	InChI=1S/C7H3ClF3NO2/c8-4-2-1-3(6(13)14)5(12-4)7(9,10)11/h1-2H,(H,13,14)
InChI Key	UDYRRHUXOXTWBD-UHFFFAOYSA-N
MDL Number	MFCD11840271
Molecular Formula	C7H3ClF3NO2
Molecular Weight	225.5524
SMILES	O=C(O)C1=C(C(F)(F)F)N=C(Cl)C=C1
Synonyms	6-Chloro-2-(trifluoromethyl)nicotinic acid, 261635-83-0, 6-chloro-2-(trifluoromethyl)pyridine-3-carboxylic Acid, 3-Pyridinecarboxylicacid, 6-chloro-2-(trifluoromethyl)-, 3-Pyridinecarboxylic acid, 6-chloro-2-(trifluoromethyl)-, SCHEMBL1267198, CTK1A1406, DTXSID40465811, KS-00000Q6K, 2248AB, ANW-62828, EBD150561, MFCD11840271, SBB052957, ZINC40447924, AKOS016003915, CS-W000652, MCULE-3248587785, NE41294, AK101621, AJ-102544, TX-010317, 4CH-000516, 2-(Trifluoromethyl)-6-chloropyridine-3-carboxylic acid, Z1815157351, C7H3ClF3NO2, ACN-055612, CID11436062, 6-chloro-2-(trifluoromethyl)nicotinicacid,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.98g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.551g/mol
Monoisotopic Mass	224.98g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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