1,2-Dimethylimidazole-5-carboxylic Acid - CAS 122222-09-7

Catalog:	BB005363
Product Name:	1,2-Dimethylimidazole-5-carboxylic Acid
CAS:	122222-09-7
Synonyms:	2,3-dimethyl-4-imidazolecarboxylic acid; 2,3-dimethylimidazole-4-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	2,3-dimethylimidazole-4-carboxylic acid
Description:	1,2-Dimethylimidazole-5-carboxylic Acid (CAS# 122222-09-7) is a useful research chemical.
Molecular Weight:	140.14
Molecular Formula:	C6H8N2O2
Canonical SMILES:	CC1=NC=C(N1C)C(=O)O
InChI:	InChI=1S/C6H8N2O2/c1-4-7-3-5(6(9)10)8(4)2/h3H,1-2H3,(H,9,10)
InChI Key:	GHSZJLADCHKTGG-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	0.42670

Publication Number	Title	Priority Date
JP-2021143176-A	Method for Producing Imidazopyridinone Compound	20200312
WO-2021106230-A1	Novel phenol compound or salt thereof	20191129
US-2021032269-A1	Sting agonist compounds and methods of use	20190802
WO-2021026009-A1	Bis-[n-((5-carbamoyl)-1h-benzo[d]imidazol-2-yl)-pyrazol-5-carboxamide] derivatives and related compounds as sting (stimulator of interferon genes) agonists for the treatment of cancer	20190802
EP-3808747-A1	Imidazopyridinone compound	20180913

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Related Functional Groups

Carbonyl Compounds

[17746-05-3]
Undecanoyl chloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-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:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.058577502
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	140.058577502
Rotatable Bond Count:	1
Topological Polar Surface Area:	55.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3