3-Pyridinecarboxylic acid, 2-methyl-2-propyl-1,3-propanediyl ester

CAS Registry Number®

13671-63-1
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CAS Name

3-Pyridinecarboxylic acid, 2-methyl-2-propyl-1,3-propanediyl ester

Molecular Formula

C19H22N2O4

Molecular Mass

342.39

Cite this Page

3-Pyridinecarboxylic acid, 2-methyl-2-propyl-1,3-propanediyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13671-63-1 (retrieved 2024-09-07) (CAS RN: 13671-63-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H22N2O4/c1-3-8-19(2,13-24-17(22)15-6-4-9-20-11-15)14-25-18(23)16-7-5-10-21-12-16/h4-7,9-12H,3,8,13-14H2,1-2H3

InChIKey

InChIKey=XVBCWIBXVAJLPL-UHFFFAOYSA-N

SMILES

C(COC(=O)C=1C=CC=NC1)(COC(=O)C=2C=CC=NC2)(CCC)C

Canonical SMILES

O=C(OCC(C)(COC(=O)C=1C=NC=CC1)CCC)C=2C=NC=CC2

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 2-methyl-2-propyl-1,3-propanediyl ester
  • Nicotinic acid, 2-methyl-2-propyltrimethylene ester
  • 1,3-Propanediol, 2-methyl-2-propyl-, dinicotinate
  • 2-Methyl-2-propylpropane-1,3-diyl dinicotinate