3-Methylpyrazine-2-carboxylic Acid - CAS 41110-28-5

Catalog:	BB024786
Product Name:	3-Methylpyrazine-2-carboxylic Acid
CAS:	41110-28-5
Synonyms:	3-methyl-2-pyrazinecarboxylic acid; 3-methylpyrazine-2-carboxylic acid

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Computed Properties

IUPAC Name:	3-methylpyrazine-2-carboxylic acid
Description:	3-Methylpyrazine-2-carboxylic Acid (CAS# 41110-28-5) is a useful research chemical.
Molecular Weight:	138.12
Molecular Formula:	C6H6N2O2
Canonical SMILES:	CC1=NC=CN=C1C(=O)O
InChI:	InChI=1S/C6H6N2O2/c1-4-5(6(9)10)8-3-2-7-4/h2-3H,1H3,(H,9,10)
InChI Key:	DEDJQZNLAXYJBT-UHFFFAOYSA-N
Boiling Point:	299.334 °C at 760 mmHg
Density:	1.319 g/cm³
MDL:	MFCD08705765
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
US-2020392155-A1	Pyrazine carbamates and their use as glun2b receptor modulators	20190614
WO-2020249796-A1	Pyrazine carbamates and their use as glun2b receptor modulators	20190614
CN-109821268-B	Purification method of 5-methylpyrazine-2-carboxylic acid crude product	20190306

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Related Functional Groups

Carbonyl Compounds

[55441-25-3]
1-(2-Cyanophenyl)urea
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic 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