3-Pyridinecarboxylicacid, ethyl ester, 1-oxide

Modify Date: 2025-08-23 19:43:41

3-Pyridinecarboxylicacid, ethyl ester, 1-oxide Structure
3-Pyridinecarboxylicacid, ethyl ester, 1-oxide structure
Common Name 3-Pyridinecarboxylicacid, ethyl ester, 1-oxide
CAS Number 14906-63-9 Molecular Weight 167.16200
Density 1.16g/cm3 Boiling Point 345.8ºC at 760mmHg
Molecular Formula C8H9NO3 Melting Point N/A
MSDS N/A Flash Point 162.9ºC

 Names

Name ethyl 1-oxidopyridin-1-ium-3-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.16g/cm3
Boiling Point 345.8ºC at 760mmHg
Molecular Formula C8H9NO3
Molecular Weight 167.16200
Flash Point 162.9ºC
Exact Mass 167.05800
PSA 51.76000
LogP 1.29180
Vapour Pressure 6.03E-05mmHg at 25°C
Index of Refraction 1.52
InChIKey HPFQJBOXPBNOJK-UHFFFAOYSA-N
SMILES CCOC(=O)c1ccc[n+]([O-])c1

 Synthetic Route

~62%

3-Pyridinecarboxylicacid, ethyl ester, 1-oxide Structure

3-Pyridinecarbo...

CAS#:14906-63-9

Literature: Mieczkowski, Jozef B. Bulletin of the Polish Academy of Sciences, Chemistry, 1984 , vol. 32, # 7-8 p. 255 - 259

~92%

3-Pyridinecarboxylicacid, ethyl ester, 1-oxide Structure

3-Pyridinecarbo...

CAS#:14906-63-9

Literature: Paul, D. Brenton Australian Journal of Chemistry, 1984 , vol. 37, # 1 p. 87 - 94

 Bioassay

View more

Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1100
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1101
Name: Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas...
Source: Broad Institute
Target: N/A
External Id: 2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: N/A
External Id: HMS1149-MLP
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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 Synonyms

Ethyl nicotinate N-Oxide
1-Oxy-nicotinsaeure-aethylester
1-oxy-nicotinic acid ethyl ester
3-ethoxycarbonylpyridine 1-oxide
ethyl nicotinate 1-oxide
nicotinic acid N-oxide ethyl ester
ethyl pyridine-3-carboxylate 1-oxide
HMS3079L19
3-ethoxycarbonylpyridine N-oxide
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