2-(1,3-Benzodioxol-5-yl)-4-thiazolidinecarboxylic acid
CAS Registry Number®
72678-96-7
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CAS Name
2-(1,3-Benzodioxol-5-yl)-4-thiazolidinecarboxylic acidMolecular Formula
C11H11NO4SMolecular Mass
253.27Cite this Page
2-(1,3-Benzodioxol-5-yl)-4-thiazolidinecarboxylic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=72678-96-7 (retrieved ) (CAS RN: 72678-96-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
167-169 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C11H11NO4S/c13-11(14)7-4-17-10(12-7)6-1-2-8-9(3-6)16-5-15-8/h1-3,7,10,12H,4-5H2,(H,13,14)
InChIKey
InChIKey=XFGXAJCIOOXIGL-UHFFFAOYSA-N
SMILES
C(O)(=O)C1NC(C=2C=C3C(=CC2)OCO3)SC1
Canonical SMILES
O=C(O)C1NC(SC1)C2=CC=C3OCOC3=C2
Other Names for this Substance
- 4-Thiazolidinecarboxylic acid, 2-(1,3-benzodioxol-5-yl)-
- 4-Thiazolidinecarboxylic acid, 2-(3,4-methylenedioxyphenyl)-
- 2-(1,3-Benzodioxol-5-yl)-4-thiazolidinecarboxylic acid
- 2-(1,3-Benzodioxol-5-yl)-1,3-thiazolidin-3-ium-4-carboxylate
- 2-(Benzo[d][1,3]dioxol-5-yl)thiazolidine-4-carboxylic acid
