CAS Registry Number: 37978-61-3

Name:

6-​Benzofurancarboxylic acid, 4-​(acetyloxy)​-​2-​methyl-​, methyl ester

Chemical Formula: C13H12O5
Exact Mass: 248.07
Molecular Weight: 248.23
m/z: 248.07 (100.0%), 249.07 (14.4%), 250.07 (1.0%)
Elemental Analysis: C, 62.90; H, 4.87; O, 32.23

InChI: InChI=1S/C13H12O5/c1-7-4-10-11(17-7)5-9(13(15)16-3)6-12(10)18-8(2)14/h4-6H,1-3H3
InChIKey: RYKAHKWLZNRCOG-UHFFFAOYSA-N
Canonical SMILES : CC1=CC2=C(O1)C=C(C=C2OC(=O)C)C(=O)OC

Specification

98%

PCT Int. Appl. (2004), WO 2004046139 A1 20040603.

Journal fuer Praktische Chemie (Leipzig) (1972), 314(2), 213-19.