2-(2-Ethoxy-2-oxoethyl)nicotinic Acid - CAS 35969-51-8

Catalog:	BB022813
Product Name:	2-(2-Ethoxy-2-oxoethyl)nicotinic Acid
CAS:	35969-51-8
Synonyms:	2-(2-ethoxy-2-oxoethyl)-3-pyridinecarboxylic acid; 2-(2-ethoxy-2-oxoethyl)pyridine-3-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-(2-ethoxy-2-oxoethyl)pyridine-3-carboxylic acid
Description:	2-(2-Ethoxy-2-oxoethyl)nicotinic Acid (CAS# 35969-51-8) is a useful research chemical.
Molecular Weight:	209.20
Molecular Formula:	C10H11NO4
Canonical SMILES:	CCOC(=O)CC1=C(C=CC=N1)C(=O)O
InChI:	InChI=1S/C10H11NO4/c1-2-15-9(12)6-8-7(10(13)14)4-3-5-11-8/h3-5H,2,6H2,1H3,(H,13,14)
InChI Key:	HWWYQJVDTXVUMB-UHFFFAOYSA-N
Boiling Point:	345.3 °C at 760 mmHg
Density:	1.271 g/cm³
MDL:	MFCD00663817
LogP:	0.88540

Publication Number	Title	Priority Date
WO-2021202284-A1	Modulators of hemoglobin	20200331
US-2020017461-A1	3-(5-hydroxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and uses thereof	20180710
WO-2020012334-A1	3-(5-hydroxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and their use in the treatment of ikaros family zinc finger 2 (ikzf2)-dependent diseases	20180710
AU-2019301944-A1	3-(5-hydroxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and their use in the treatment of Ikaros family zinc finger 2 (IKZF2)-dependent diseases	20180710
BR-112020026947-A2	DERIVATIVES OF 3- (5-HYDROXY-1-OXOISOINDOLIN-2-IL) PIPERIDIN-2,6-DIONA AND ITS USE IN THE TREATMENT OF ZINC FINGER-RELATED DISEASES OF THE IKAROS 2 FAMILY (IKZF2)	20180710

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Related Functional Groups

Pyridines

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1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[14993-80-7]
2-(6-Methylpyridin-2-yl)acetonitrile
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	242
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	209.06880783
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	209.06880783
Rotatable Bond Count:	5
Topological Polar Surface Area:	76.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6