AG004WXK

82846-28-4 | 6-(Dimethylamino)nicotinic acid

AG004WXK

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CAS Number	82846-28-4
Catalog Number	AG004WXK(AGN-PC-0JM3HL)
Chemical Name	6-(Dimethylamino)nicotinic acid
IUPAC Name	6-(dimethylamino)pyridine-3-carboxylic acid
InChI	InChI=1S/C8H10N2O2/c1-10(2)7-4-3-6(5-9-7)8(11)12/h3-5H,1-2H3,(H,11,12)
InChI Key	XWMLEYINWKGSAC-UHFFFAOYSA-N
MDL Number	MFCD07357408
Molecular Formula	C8H10N2O2
Molecular Weight	166.1772
NSC Number	196545
SMILES	CN(C)C1=CC=C(C=N1)C(O)=O
UNII	21E3K6C9ZU
Synonyms	6-(dimethylamino)nicotinic acid, 82846-28-4, 6-(dimethylamino)pyridine-3-carboxylic acid, 3-Pyridinecarboxylic acid, 6-(dimethylamino)-, 6-(DIMETHYLAMINO)-3-PYRIDINECARBOXYLIC ACID, UNII-21E3K6C9ZU, 6-dimethylaminonicotinic acid, 21E3K6C9ZU, 6-(Dimethylamino)-nicotinic acid, 46L, NSC196545, NSC 196545, AC1Q3WJF, AC1Q3WKX, AC1L40QJ, SCHEMBL185127, 6-dimethylamino nicotinic acid, CHEMBL394288, CTK3E9244, DTXSID90232030, XWMLEYINWKGSAC-UHFFFAOYSA-N, ALBB-013444, CS-B1321, ZINC1734973, 2805AC, ANW-71683, AR3311, BBL036745, MFCD07357408, AKOS000215148, AB30638, MCULE-2291955429, NSC-196545, BS-13651, EN001406, AB0086970, DB-075885, TC-160428, 6-(Dimethylamino)nicotinic acid, AldrichCPR, FT-0683722, 3-Pyridinecarboxylic acid,6-(dimethylamino)-, 6-(dimethylamino)-3-Pyridine carboxylic acid, EN300-35909, C-1744, I02-4611, F8889-8184, Z367451024, 6-(Dimethylamino)nicotinicacid, C8H10N2O2, CID99209, AR-1G9990, C8-H10-N2-O2, 1-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine, 87913-20-0,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.074g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	166.18g/mol
Monoisotopic Mass	166.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P280
UN Code

Certificate of Analysis

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