3-Pyridineacetic acid

Catalog Number	ACM501815
CAS	501-81-5
Structure
IUPAC Name	2-pyridin-3-ylacetic acid
Synonyms	3-pyridineacetic acid;3-pyridylacetic acid;501-81-5;2-(pyridin-3-yl)acetic acid;piridil;Piristerol;lessterol;lioxone;minedil;toneon;2-(3-pyridyl)acetic acid;coletin;pyridine-3-acetic acid;2-pyridin-3-ylacetic acid;pyridin-3-ylacetic acid;UNII-7UFO07435N;3-Pyridineacetic acid HCl;3-Pyridinylacetic acid;NSC70769;NSC 70769;(pyridin-3-yl)acetic acid;CHEBI:86390;7UFO07435N;NSC-70769;3-pyridylacetate;3-pyridine-acetic acid;MFCD00066302;3-Pyridylaceticacid;3-pyridyl acetic acid;3-Pyridylaceticacidhydrochloride;EINECS 207-928-7;Pyridin-3-ylacetate;3-pyridyl-acetic acid;3-Carboxymethylpyridine;a-(3-Pyridyl)acetate;3-Pyridine acetic acid;2-(3-Pyridyl)acetate;ACMC-1ATTG;(3-pyridyl)ethanoic acid;pyridin-3-yl-acetic acid;3-Pyridinylacetic acid #;alpha-(3-Pyridyl)acetate;(Pyridin-3-yl)acetic aci;2-(Pyridin-3-yl)acetate;a-(3-Pyridyl)acetic acid;NCIStruc1_001832;NCIStruc2_000005;3-Pyridylacetic Acid-[d6];Oprea1_245722;SCHEMBL48609;alpha-(3-Pyridyl)acetic acid;GTPL1590;CHEMBL1741437;DTXSID3060110;HMS1648N01;ZINC152270;ALBB-033044;BCP20278;NCI70769;ANW-30926;BBL001481;CCG-37668;NCGC00013785;SBB005848;STL102634;AKOS000200472;CS-W016522;DS-0484;FG-0453;HY-W015806;MCULE-5025740933;VP13557;3-Pyridineacetic acid,sodium salt(1:1);NCGC00013785-02;NCGC00096895-01;AC-24998;AK-26036;NCI60_038230;DB-006521;AM20070145;BB 0259224;EU-0033240;FT-0601403;FT-0674203;EN300-53587;M-7609;Pyridin-3-yl-acetic acid; 3-Pyridine acetic acid;J-506582;J-800109;Q27073746;F8880-7238;Z1245635769
Molecular Weight	137.14g/mol
Molecular Formula	C7H7NO2
Canonical SMILES	C1=CC(=CN=C1)CC(=O)O
InChI	InChI=1S/C7H7NO2/c9-7(10)4-6-2-1-3-8-5-6/h1-3,5H,4H2,(H,9,10)
InChI Key	WGNUNYPERJMVRM-UHFFFAOYSA-N
Melting Point	144.0 °C
Complexity	125
Covalently-Bonded Unit Count	1
EC Number	229-148-6;207-928-7
Exact Mass	137.047678466g/mol
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Monoisotopic Mass	137.047678466g/mol
NSC Number	70769
Rotatable Bond Count	2
Topological Polar Surface Area	50.2Å²
UNII	7UFO07435N
X Log P3	-0.1

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