Butanedioic acid, 2,3-bis(benzoyloxy)-, hydrate (1:1), (2S,3S)-

CAS Registry Number®

80822-15-7

CAS Name

Butanedioic acid, 2,3-bis(benzoyloxy)-, hydrate (1:1), (2S,3S)-

Molecular Formula

C18H14O8.H2O

Cite this Page

Butanedioic acid, 2,3-bis(benzoyloxy)-, hydrate (1:1), (2S,3S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80822-15-7 (retrieved 2024-11-22) (CAS RN: 80822-15-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    91-93 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H14O8.H2O/c19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12;/h1-10,13-14H,(H,19,20)(H,21,22);1H2/t13-,14-;/m0./s1

InChIKey

InChIKey=DXDIHODZARUBLA-IODNYQNNSA-N

SMILES

[C@@H]([C@H](OC(=O)C1=CC=CC=C1)C(O)=O)(OC(=O)C2=CC=CC=C2)C(O)=O.O

Canonical SMILES

O=C(OC(C(=O)O)C(OC(=O)C=1C=CC=CC1)C(=O)O)C=2C=CC=CC2.O

Other Names for this Substance

  • Butanedioic acid, 2,3-bis(benzoyloxy)-, hydrate (1:1), (2S,3S)-
  • Butanedioic acid, 2,3-bis(benzoyloxy)-, monohydrate, [S-(R*,R*)]-
  • Butanedioic acid, 2,3-bis(benzoyloxy)-, monohydrate, (2S,3S)-
  • D-(+)-Dibenzoyl tartaric acid monohydrate

CAS INSIGHTSTM
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