AG003A50

39977-41-8 | 5-(hydroxymethyl)-2-Pyridinecarboxylic acid

AG003A50

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CAS Number	39977-41-8
Catalog Number	AG003A50(AGN-PC-00MVTW)
Chemical Name	5-(hydroxymethyl)-2-Pyridinecarboxylic acid
IUPAC Name	5-(hydroxymethyl)pyridine-2-carboxylic acid
InChI	InChI=1S/C7H7NO3/c9-4-5-1-2-6(7(10)11)8-3-5/h1-3,9H,4H2,(H,10,11)
InChI Key	JFOQWSKCLFWNSW-UHFFFAOYSA-N
MDL Number	MFCD11520014
Molecular Formula	C7H7NO3
Molecular Weight	153.1354
SMILES	OCC=1C=CC(=NC1)C(=O)O
Synonyms	5-(Hydroxymethyl)picolinic acid, 39977-41-8, 5-Hydroxymethyl-pyridine-2-carboxylic acid, AK127091, SCHEMBL287277, KS-00000RAC, DTXSID10542789, 2-Carboxy-5-hydroxymethylpyridine, JFOQWSKCLFWNSW-UHFFFAOYSA-N, FCH894461, MFCD11520014, ZINC34078178, AKOS006324502, DS-5441, AJ-86815, 5-(hydroxymethyl)pyridine-2-carboxylic acid, AX8248882, DB-069903, 4CH-019709, 5-(Hydroxymethyl)-2-pyridinecarboxylic acid, FT-0755937, ST24044251, 5-(Hydroxymethyl)picolinicacid,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.043g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	153.137g/mol
Monoisotopic Mass	153.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	70.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number