α,α-Dimethyl-γ-oxo-1,3-benzodioxole-5-butanoic acid
CAS Registry Number®
951894-07-8
No image available.
CAS Name
α,α-Dimethyl-γ-oxo-1,3-benzodioxole-5-butanoic acidMolecular Formula
C13H14O5Molecular Mass
250.25Cite this Page
α,α-Dimethyl-γ-oxo-1,3-benzodioxole-5-butanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=951894-07-8 (retrieved ) (CAS RN: 951894-07-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
178.2-179.3 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H14O5/c1-13(2,12(15)16)6-9(14)8-3-4-10-11(5-8)18-7-17-10/h3-5H,6-7H2,1-2H3,(H,15,16)
InChIKey
InChIKey=GZYYGDDNGZXXOK-UHFFFAOYSA-N
SMILES
C(CC(C(O)=O)(C)C)(=O)C=1C=C2C(=CC1)OCO2
Canonical SMILES
O=C(O)C(C)(C)CC(=O)C1=CC=C2OCOC2=C1
Other Names for this Substance
- 1,3-Benzodioxole-5-butanoic acid, α,α-dimethyl-γ-oxo-
- α,α-Dimethyl-γ-oxo-1,3-benzodioxole-5-butanoic acid