![Chemical structure of 5-[(3,4-Ethylenedioxy)phenyl]-5-oxovaleric acid, CAS 845781-54-6](https://api.angenesci.com/structure/2602/845781-54-6.png)
| CAS Number | 845781-54-6 |
| Catalog Number | AG0052AT(AGN-PC-0WCDS0) |
| Chemical Name | 5-[(3,4-Ethylenedioxy)phenyl]-5-oxovaleric acid |
| IUPAC Name | 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopentanoic acid |
| InChI | InChI=1S/C13H14O5/c14-10(2-1-3-13(15)16)9-4-5-11-12(8-9)18-7-6-17-11/h4-5,8H,1-3,6-7H2,(H,15,16) |
| InChI Key | SZCDSMJFYQLPCC-UHFFFAOYSA-N |
| MDL Number | MFCD06201684 |
| Molecular Formula | C13H14O5 |
| Molecular Weight | 250.2473 |
| SMILES | OC(CCCC(C1=CC2=C(OCCO2)C=C1)=O)=O |
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