4,4-Bis(2-carboxyphenyl) 5-oxo-1,3-dioxolane-4,4-diacetate
CAS Registry Number®
1400-58-4
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CAS Name
4,4-Bis(2-carboxyphenyl) 5-oxo-1,3-dioxolane-4,4-diacetateMolecular Formula
C21H16O11Molecular Mass
444.35Cite this Page
4,4-Bis(2-carboxyphenyl) 5-oxo-1,3-dioxolane-4,4-diacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1400-58-4 (retrieved ) (CAS RN: 1400-58-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
150-161 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C21H16O11/c22-16(31-14-7-3-1-5-12(14)18(24)25)9-21(20(28)29-11-30-21)10-17(23)32-15-8-4-2-6-13(15)19(26)27/h1-8H,9-11H2,(H,24,25)(H,26,27)
InChIKey
InChIKey=MZRMRMTUUHHONC-UHFFFAOYSA-N
SMILES
C(C(OC1=C(C(O)=O)C=CC=C1)=O)C2(CC(OC3=C(C(O)=O)C=CC=C3)=O)C(=O)OCO2
Canonical SMILES
O=C(O)C=1C=CC=CC1OC(=O)CC2(OCOC2=O)CC(=O)OC=3C=CC=CC3C(=O)O
Other Names for this Substance
- 1,3-Dioxolane-4,4-diacetic acid, 5-oxo-, 4,4-bis(2-carboxyphenyl) ester
- Novaspirin
- 1,3-Dioxolane-4,4-diacetic acid, 5-oxo-, bis(2-carboxyphenyl) ester
- 4,4-Bis(2-carboxyphenyl) 5-oxo-1,3-dioxolane-4,4-diacetate
- Citrosalic acid
Deleted or Replaced CAS Registry Numbers
53112-35-9
