5-Carboxy-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)-2H-isoindole-2-acetic acid

CAS Registry Number®

131613-55-3
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CAS Name

5-Carboxy-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)-2H-isoindole-2-acetic acid

Molecular Formula

C18H13NO6

Molecular Mass

339.30

Cite this Page

5-Carboxy-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)-2H-isoindole-2-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=131613-55-3 (retrieved 2024-09-09) (CAS RN: 131613-55-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    232-234 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C18H13NO6/c20-15-12-7-6-11(17(22)23)9-13(12)16(21)19(15)14(18(24)25)8-10-4-2-1-3-5-10/h1-7,9,14H,8H2,(H,22,23)(H,24,25)

InChIKey

InChIKey=BUXYTSPIQFCVLN-UHFFFAOYSA-N

SMILES

C(CC1=CC=CC=C1)(C(O)=O)N2C(=O)C=3C(C2=O)=CC=C(C(O)=O)C3

Canonical SMILES

O=C(O)C1=CC=C2C(=O)N(C(=O)C2=C1)C(C(=O)O)CC=3C=CC=CC3

Other Names for this Substance

  • 2H-Isoindole-2-acetic acid, 5-carboxy-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)-
  • 2H-Isoindole-2-acetic acid, 5-carboxy-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)-, (±)-
  • 5-Carboxy-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)-2H-isoindole-2-acetic acid
  • 2-(1-Carboxy-2-phenylethyl)-1,3-dioxoisoindole-5-carboxylic acid
  • 2-(1-Carboxy-2-phenyl-ethyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid

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