4-Quinolinecarboxylic acid, 2,5,7-trimethyl-, hydrate (1:1)

CAS Registry Number®

1609403-65-7
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CAS Name

4-Quinolinecarboxylic acid, 2,5,7-trimethyl-, hydrate (1:1)

Molecular Formula

C13H13NO2.H2O

Cite this Page

4-Quinolinecarboxylic acid, 2,5,7-trimethyl-, hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1609403-65-7 (retrieved 2024-07-07) (CAS RN: 1609403-65-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H13NO2.H2O/c1-7-4-8(2)12-10(13(15)16)6-9(3)14-11(12)5-7;/h4-6H,1-3H3,(H,15,16);1H2

InChIKey

InChIKey=TVEUEDUQCOEJNU-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C2=C(N=C(C)C1)C=C(C)C=C2C.O

Canonical SMILES

O=C(O)C1=CC(=NC2=CC(=CC(=C21)C)C)C.O

Other Names for this Substance

  • 4-Quinolinecarboxylic acid, 2,5,7-trimethyl-, hydrate (1:1)