1-Isoquinolinecarboxylic acid

486-73-7

CAS Name

1-Isoquinolinecarboxylic acid

Molecular Formula

C₁₀H₇NO₂

Molecular Mass

173.17

Compound Properties

• Melting Point (1)

  159-160 °C

Source(s)

• (1) Davis, Jefferson W. Jr.; Journal of Organic Chemistry, (1960), 25, 376-8, CAplus

Other Names and Identifiers

InChI

InChI=1S/C10H7NO2/c12-10(13)9-8-4-2-1-3-7(8)5-6-11-9/h1-6H,(H,12,13)

InChIKey

InChIKey=XAAKCCMYRKZRAK-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C2=C(C=CN1)C=CC=C2

Canonical SMILES

O=C(O)C1=NC=CC=2C=CC=CC21

Other Names for this Substance