3-Methylpyridine-2-carboxylic acid - CAS 4021-07-2

Catalog:	BB024369
Product Name:	3-Methylpyridine-2-carboxylic acid
CAS:	4021-07-2
Synonyms:	3-methylpyridine-2-carboxylic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	3-methylpyridine-2-carboxylic acid
Description:	3-Methylpyridine-2-carboxylic acid (CAS# 4021-07-2) is a useful research chemical.
Molecular Weight:	137.14
Molecular Formula:	C7H7NO2
Canonical SMILES:	CC1=C(N=CC=C1)C(=O)O
InChI:	InChI=1S/C7H7NO2/c1-5-3-2-4-8-6(5)7(9)10/h2-4H,1H3,(H,9,10)
InChI Key:	LMHIBYREWJHKNZ-UHFFFAOYSA-N
Boiling Point:	300.6 °C at 760 mmHg
Density:	1.23 g/cm³
MDL:	MFCD00191553
LogP:	1.08820

Publication Number	Title	Priority Date
KR-20200021494-A	Novel nucleoside or nucleotide derivatives, and use thereof	20200220
KR-102145025-B1	Novel nucleoside or nucleotide derivatives, and use thereof	20200220
WO-2021007477-A1	Indazoles and azaindazoles as lrrk2 inhibitors	20190711
WO-2020243559-A1	Pressure sensitive adhesives made from uv curing of plant oil-based polyesters	20190531
CN-110105270-A	The synthetic method of compound in a kind of Î²-chlorine of no metal catalytic	20190530

PMID	Publication Date	Title	Journal
21588794	20101002	Poly[[diaqua-tris-(μ(2)-3-methyl-pyridine-2-carboxyl-ato)(3-methyl-pyridine-2-car-boxyl-ato)sodiumterbium(III)] ethanol monosolvate monohydrate]	Acta crystallographica. Section E, Structure reports online
21588508	20100818	catena-Poly[sodium [[tris(3-methyl-pyridine-2-carboxylato)europate(III)]-μ-3-methylpyridine-2-carboxylato] trihydrate]	Acta crystallographica. Section E, Structure reports online
19787298	20100201	Crystal structure, DNA binding studies, nucleolytic property and topoisomerase I inhibition of zinc complex with 1,10-phenanthroline and 3-methyl-picolinic acid	Biometals : an international journal on the role of metal ions in biology, biochemistry, and medicine
16254941	20051201	Design of a hairpin polyamide, ZT65B, for targeting the inverted CCAAT box (ICB) site in the multidrug resistant (MDR1) gene	Chembiochem : a European journal of chemical biology

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Related Functional Groups

Carbonyl Compounds

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2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1427004-19-0]
DBCO-PEG4-NHS ester
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Pyridines

[1951441-75-0]
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride
[14993-80-7]
2-(6-Methylpyridin-2-yl)acetonitrile
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[76167-49-2]
2-(Pyridin-3-yloxy)aniline
[149463-07-0]
2-(Chloromethyl)-3-fluoropyridine Hydrochloride
[1261365-99-4]
2,5-Dichloro-6-(hydroxymethyl)pyridin-3-ol

GHS Hazard Statement:	H302 (19.23%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.047678466
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	137.047678466
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1