Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethylnicotinate
RN: 614-18-6
UNII: NIJ3H353YH
InChIKey: XBLVHTDFJBKJLG-UHFFFAOYSA-N

Molecular Formula

  • C8-H9-N-O2

Molecular Weight

  • 151.164
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Ethylnicotinate

Synonyms

  • 3-(Ethoxycarbonyl)pyridine
  • 3-Carbethoxypyridine
  • 3-Pyridinecarboxylic acid, ethyl ester
  • AI3-02579
  • Ba 2673
  • beta-Pyridinecarboxylic acid ethyl ester
  • EINECS 210-370-7
  • Ethyl 3-pyridinecarboxylate
  • Ethyl nicotinate
  • Ethyl-nicotinate
  • Ignicut
  • Ignocut
  • Mucotherm
  • Nicaethan
  • Nicotinic acid,ethyl ester
  • Nikethan
  • Nikithan
  • NSC 8872
  • UNII-NIJ3H353YH

Systematic Names

  • 3-Pyridinecarboxylic acid, ethyl ester
  • Ethyl nicotinate
  • Nicotinic acid, ethyl ester (8CI)

Registry Numbers

CAS Registry Number

  • 614-18-6

FDA UNII

  • NIJ3H353YH

Other Registry Number

  • 123574-71-0

System Generated Number

  • 0000614186

Structure Descriptors

InChI

1S/C8H9NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h3-6H,2H2,1H3

InChIKey

XBLVHTDFJBKJLG-UHFFFAOYSA-N

Smiles

O=C(OCC)c1cccnc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 8.5 deg C   EXP
Boiling Point 224 deg C   EXP
pKa Dissociation Constant 3.35 (none) 20 EXP
log P (octanol-water) 1.32 (none)   EXP
Water Solubility 5.60E+04 mg/L 25 EXP
Vapor Pressure 0.084 mm Hg 25 EST
Henry's Law Constant 6.03E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.78E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.