3-Pyridinecarboxylic acid, 2-phenylethyl ester

CAS Registry Number®

71653-43-5
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CAS Name

3-Pyridinecarboxylic acid, 2-phenylethyl ester

Molecular Formula

C14H13NO2

Molecular Mass

227.26

Cite this Page

3-Pyridinecarboxylic acid, 2-phenylethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71653-43-5 (retrieved 2024-08-29) (CAS RN: 71653-43-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    197-199 °C @ Press: 12 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H13NO2/c16-14(13-7-4-9-15-11-13)17-10-8-12-5-2-1-3-6-12/h1-7,9,11H,8,10H2

InChIKey

InChIKey=BSTITMHKRRGVPH-UHFFFAOYSA-N

SMILES

C(OCCC1=CC=CC=C1)(=O)C=2C=CC=NC2

Canonical SMILES

O=C(OCCC=1C=CC=CC1)C=2C=NC=CC2

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 2-phenylethyl ester
  • Nicotinic acid, phenethyl ester
  • Phenethyl alcohol, nicotinate
  • Phenethyl 3-pyridinecarboxylate
  • 2-Phenylethyl nicotinate