3-Pyridinecarboxylic acid, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)

CAS Registry Number®

1641-74-3

CAS Name

3-Pyridinecarboxylic acid, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)

Molecular Formula

C12H18N2O2.C6H8O7

Cite this Page

3-Pyridinecarboxylic acid, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1641-74-3 (retrieved 2024-11-22) (CAS RN: 1641-74-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    123 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18N2O2.C6H8O7/c1-3-14(4-2)8-9-16-12(15)11-6-5-7-13-10-11;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-7,10H,3-4,8-9H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey

InChIKey=IABBAGAOMDWOCW-UHFFFAOYSA-N

SMILES

C(OCCN(CC)CC)(=O)C=1C=CC=NC1.C(CC(O)=O)(CC(O)=O)(C(O)=O)O

Canonical SMILES

O=C(O)CC(O)(C(=O)O)CC(=O)O.O=C(OCCN(CC)CC)C=1C=NC=CC1

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • Nicotinic acid, 2-(diethylamino)ethyl ester, citrate (1:1)
  • 53-11 C
  • 2-Diethylaminoethyl nicotinate citrate
  • Euclidan

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration