rel-Methyl (αS)-1,3-dihydro-α-[(1R)-1-hydroxyethyl]-1,3-dioxo-2H-isoindole-2-acetate

CAS Registry Number®

39739-08-7
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CAS Name

rel-Methyl (αS)-1,3-dihydro-α-[(1R)-1-hydroxyethyl]-1,3-dioxo-2H-isoindole-2-acetate

Molecular Formula

C13H13NO5

Molecular Mass

263.25

Cite this Page

rel-Methyl (αS)-1,3-dihydro-α-[(1R)-1-hydroxyethyl]-1,3-dioxo-2H-isoindole-2-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=39739-08-7 (retrieved 2024-08-04) (CAS RN: 39739-08-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C13H13NO5/c1-7(15)10(13(18)19-2)14-11(16)8-5-3-4-6-9(8)12(14)17/h3-7,10,15H,1-2H3/t7-,10+/s2

InChIKey

InChIKey=XQMNCJKSXOXYGO-NAJNNQRLNA-N

SMILES

[C@H](C(OC)=O)([C@H](C)O)N1C(=O)C=2C(C1=O)=CC=CC2

Canonical SMILES

O=C(OC)C(N1C(=O)C=2C=CC=CC2C1=O)C(O)C

Other Names for this Substance

  • 2H-Isoindole-2-acetic acid, 1,3-dihydro-α-[(1R)-1-hydroxyethyl]-1,3-dioxo-, methyl ester, (αS)-rel-
  • 2H-Isoindole-2-acetic acid, 1,3-dihydro-α-(1-hydroxyethyl)-1,3-dioxo-, methyl ester, (R*,S*)-(±)-
  • 2H-Isoindole-2-acetic acid, 1,3-dihydro-α-(1-hydroxyethyl)-1,3-dioxo-, methyl ester, (R*,S*)-
  • rel-Methyl (αS)-1,3-dihydro-α-[(1R)-1-hydroxyethyl]-1,3-dioxo-2H-isoindole-2-acetate
  • N-Phthaloyl-DL-threonine methyl ester