5,6-Dimethylxanthenone-4-acetic acid
CAS Registry Number®
117570-53-3
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CAS Name
5,6-Dimethylxanthenone-4-acetic acidMolecular Formula
C17H14O4Molecular Mass
282.29Cite this Page
5,6-Dimethylxanthenone-4-acetic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=117570-53-3 (retrieved ) (CAS RN: 117570-53-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
259-261 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C17H14O4/c1-9-6-7-13-15(20)12-5-3-4-11(8-14(18)19)17(12)21-16(13)10(9)2/h3-7H,8H2,1-2H3,(H,18,19)
InChIKey
InChIKey=XGOYIMQSIKSOBS-UHFFFAOYSA-N
SMILES
C(C(O)=O)C1=C2C(C(=O)C=3C(O2)=C(C)C(C)=CC3)=CC=C1
Canonical SMILES
O=C(O)CC=1C=CC=C2C(=O)C3=CC=C(C(=C3OC21)C)C
Other Names for this Substance
- 9H-Xanthene-4-acetic acid, 5,6-dimethyl-9-oxo-
- 5,6-Dimethyl-9-oxo-9H-xanthene-4-acetic acid
- 5,6-Dimethylxanthenone-4-acetic acid
- NSC 640488
- DMXAA
