6-Methylpyrazine-2-carboxylic Acid - CAS 5521-61-9

Catalog:	BB028951
Product Name:	6-Methylpyrazine-2-carboxylic Acid
CAS:	5521-61-9
Synonyms:	6-methyl-2-pyrazinecarboxylic acid; 6-methylpyrazine-2-carboxylic acid

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Computed Properties

IUPAC Name:	6-methylpyrazine-2-carboxylic acid
Description:	6-Methylpyrazine-2-carboxylic Acid (CAS# 5521-61-9) is a useful research chemical.
Molecular Weight:	138.12
Molecular Formula:	C6H6N2O2
Canonical SMILES:	CC1=NC(=CN=C1)C(=O)O
InChI:	InChI=1S/C6H6N2O2/c1-4-2-7-3-5(8-4)6(9)10/h2-3H,1H3,(H,9,10)
InChI Key:	YDSUJIRXXROKQG-UHFFFAOYSA-N
Boiling Point:	302.8 °C at 760 mmHg
Density:	1.319 g/cm³
MDL:	MFCD08705756
LogP:	0.48320

Publication Number	Title	Priority Date
KR-102178181-B1	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	20200331
KR-20200076655-A	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	20200331
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-2021141740-A1	Low odor high level disinfectant	20200107

PMID	Publication Date	Title	Journal
21578150	20091023	Poly[[bis-(μ(2)-6-methyl-pyrazin-2-carboxyl-ato-κN,O:N)copper(II)] dihydrate]	Acta crystallographica. Section E, Structure reports online
18586457	20081101	Suppression of blood lipid concentrations by volatile Maillard reaction products	Nutrition (Burbank, Los Angeles County, Calif.)

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
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[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[55441-25-3]
1-(2-Cyanophenyl)urea
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	138.042927438
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	138.042927438
Rotatable Bond Count:	1
Topological Polar Surface Area:	63.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5