4,5,6,7-Tetrahydro-3,6,6-trimethyl-4-oxo-2-benzofurancarboxylic acid
CAS Registry Number®
121625-80-7
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CAS Name
4,5,6,7-Tetrahydro-3,6,6-trimethyl-4-oxo-2-benzofurancarboxylic acidMolecular Formula
C12H14O4Molecular Mass
222.24Cite this Page
4,5,6,7-Tetrahydro-3,6,6-trimethyl-4-oxo-2-benzofurancarboxylic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=121625-80-7 (retrieved ) (CAS RN: 121625-80-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
195-197 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C12H14O4/c1-6-9-7(13)4-12(2,3)5-8(9)16-10(6)11(14)15/h4-5H2,1-3H3,(H,14,15)
InChIKey
InChIKey=AUDCUKXUYOTTBM-UHFFFAOYSA-N
SMILES
CC=1C2=C(OC1C(O)=O)CC(C)(C)CC2=O
Canonical SMILES
O=C(O)C=1OC2=C(C(=O)CC(C)(C)C2)C1C
Other Names for this Substance
- 2-Benzofurancarboxylic acid, 4,5,6,7-tetrahydro-3,6,6-trimethyl-4-oxo-
- 4,5,6,7-Tetrahydro-3,6,6-trimethyl-4-oxo-2-benzofurancarboxylic acid
- 3,6,6-Trimethyl-4-oxo-4,5,6,7-tetrahydro-benzofuran-2-carboxylic acid
- 3,6,6-Trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxylic acid
- 3,6,6-Trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylic acid
