Gentianine

CAS Registry Number®

439-89-4

CAS Name

Gentianine

Molecular Formula

C10H9NO2

Molecular Mass

175.18

Cite this Page

Gentianine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=439-89-4 (retrieved 2024-11-22) (CAS RN: 439-89-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    81-83 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H9NO2/c1-2-7-5-11-6-9-8(7)3-4-13-10(9)12/h2,5-6H,1,3-4H2

InChIKey

InChIKey=DFNZYFAJQPLJFI-UHFFFAOYSA-N

SMILES

C(=C)C1=C2C(C(=O)OCC2)=CN=C1

Canonical SMILES

O=C1OCCC=2C(=CN=CC12)C=C

Other Names for this Substance

  • 1H-Pyrano[3,4-c]pyridin-1-one, 5-ethenyl-3,4-dihydro-
  • 1H-Pyrano[3,4-c]pyridin-1-one, 3,4-dihydro-5-vinyl-
  • Gentianine
  • Nicotinic acid, 4-(2-hydroxyethyl)-5-vinyl-, δ-lactone
  • 5-Ethenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridin-1-one

View All