1,2,3,6,7,7a-Hexahydro-2-(4-methylphenyl)-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid

CAS Registry Number®

14261-91-7

CAS Name

1,2,3,6,7,7a-Hexahydro-2-(4-methylphenyl)-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid

Molecular Formula

C16H15NO4

Molecular Mass

285.29

Cite this Page

1,2,3,6,7,7a-Hexahydro-2-(4-methylphenyl)-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14261-91-7 (retrieved 2024-11-25) (CAS RN: 14261-91-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    183-184 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H15NO4/c1-9-2-4-10(5-3-9)17-8-16-7-6-11(21-16)12(15(19)20)13(16)14(17)18/h2-7,11-13H,8H2,1H3,(H,19,20)

InChIKey

InChIKey=KUFKGDZHWPMXNX-UHFFFAOYSA-N

SMILES

C(O)(=O)C1C2C3(CN(C2=O)C4=CC=C(C)C=C4)OC1C=C3

Canonical SMILES

O=C(O)C1C2OC3(C=C2)CN(C4=CC=C(C=C4)C)C(=O)C13

Other Names for this Substance

  • 3a,6-Epoxy-3aH-isoindole-7-carboxylic acid, 1,2,3,6,7,7a-hexahydro-2-(4-methylphenyl)-1-oxo-
  • 3a,6-Epoxy-3aH-isoindole-7-carboxylic acid, 1,2,3,6,7,7a-hexahydro-1-oxo-2-p-tolyl-
  • 1,2,3,6,7,7a-Hexahydro-2-(4-methylphenyl)-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid

CAS INSIGHTSTM
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