Pentanedioic acid, 2-oxo-, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:2)

CAS Registry Number®

93803-23-7
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CAS Name

Pentanedioic acid, 2-oxo-, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:2)

Molecular Formula

C8H11NO3.1/2C5H6O5

Cite this Page

Pentanedioic acid, 2-oxo-, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:2).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93803-23-7 (retrieved 2024-08-29) (CAS RN: 93803-23-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H11NO3.C5H6O5/c1-5-8(12)7(4-11)6(3-10)2-9-5;6-3(5(9)10)1-2-4(7)8/h2,10-12H,3-4H2,1H3;1-2H2,(H,7,8)(H,9,10)

InChIKey

InChIKey=MLAUVUHGQARGDU-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)(C(O)=O)=O.C(O)C=1C(CO)=CN=C(C)C1O

Canonical SMILES

O=C(O)C(=O)CCC(=O)O.OC=1C(=NC=C(C1CO)CO)C

Other Names for this Substance

  • Pentanedioic acid, 2-oxo-, compd. with 5-hydroxy-6-methyl-3,4-pyridinedimethanol (1:2)
  • 3,4-Pyridinedimethanol, 5-hydroxy-6-methyl-, 2-oxopentanedioate (2:1) (salt)