1-Ethylimidazole-5-carboxylic Acid - CAS 71925-11-6

Catalog:	BB034498
Product Name:	1-Ethylimidazole-5-carboxylic Acid
CAS:	71925-11-6
Synonyms:	3-ethyl-4-imidazolecarboxylic acid; 3-ethylimidazole-4-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	3-ethylimidazole-4-carboxylic acid
Description:	1-Ethylimidazole-5-carboxylic Acid (CAS# 71925-11-6) is a useful research chemical.
Molecular Weight:	140.14
Molecular Formula:	C6H8N2O2
Canonical SMILES:	CCN1C=NC=C1C(=O)O
InChI:	InChI=1S/C6H8N2O2/c1-2-8-4-7-3-5(8)6(9)10/h3-4H,2H2,1H3,(H,9,10)
InChI Key:	QXDVIFCTZBKLMY-UHFFFAOYSA-N
LogP:	0.60120

Publication Number	Title	Priority Date
CN-113480534-A	Benzimidazole or azabenzimidazole-6-carboxylic acid compounds and application thereof	20210723
WO-2020132549-A1	Sting heterocycle agonists and uses thereof	20181221
US-2016145247-A1	Aminomethyl-Biaryl Derivatives Complement Factor D inhibitors and uses thereof	20130718
WO-2013180128-A1	4-[4-(5-membered aromatic heterocyclic carbonyl ureide)phenyloxy]quinoline derivative	20120528
EP-2683710-B1	Soluble guanylate cyclase activators	20110310

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[17746-05-3]
Undecanoyl chloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

Complexity:	138
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:	2
Topological Polar Surface Area:	55.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2