AG004T1B

83282-46-6 | 3,6-DIMETHYLPICOLINIC ACID

AG004T1B

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CAS Number	83282-46-6
Catalog Number	AG004T1B(AGN-PC-00LH3C)
Chemical Name	3,6-DIMETHYLPICOLINIC ACID
IUPAC Name	3,6-dimethylpyridine-2-carboxylic acid
InChI	InChI=1S/C8H9NO2/c1-5-3-4-6(2)9-7(5)8(10)11/h3-4H,1-2H3,(H,10,11)
InChI Key	DGPLAIQJEYPASJ-UHFFFAOYSA-N
MDL Number	MFCD12401109
Molecular Formula	C8H9NO2
Molecular Weight	151.1626
SMILES	CC1=CC=C(C)C(=N1)C(O)=O
Synonyms	3,6-Dimethylpicolinic acid, 83282-46-6, 3,6-DIMETHYL-2-PYRIDINECARBOXYLIC ACID, 3,6-DIMETHYLPYRIDINE-2-CARBOXYLIC ACID, 2-Pyridinecarboxylicacid,3,6-dimethyl-, SCHEMBL2373944, CTK8C1333, DTXSID00527989, DGPLAIQJEYPASJ-UHFFFAOYSA-N, KS-00000HG3, 2855AC, ANW-66282, MFCD12401109, ZINC39057555, AB65474, 3?6-Dimethylpyridine-2-carboxylic acid, 3,6-dimethyl-pyridine-2-carboxylic acid, AJ-97714, AK-76881, DA-17665, DS-16763, QC-11122, TC-155027, FT-0752812, 2-PYRIDINECARBOXYLIC ACID, 3,6-DIMETHYL-, C8H9NO2, 2-Pyridinecarboxylic acid, 3,6-dimethyl- (9CI),

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	151.063g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	151.165g/mol
Monoisotopic Mass	151.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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