0JD
(2S)-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid
Find entries where: 0JD
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
|---|---|
| Name | (2S)-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid |
| Identifiers | (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid |
| Formula | C9 H8 O4 |
| Molecular Weight | 180.157 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1ccc2c(c1)OC[C@H](O2)C(=O)O |
| InChI | InChI=1S/C9H8O4/c10-9(11)8-5-12-6-3-1-2-4-7(6)13-8/h1-4,8H,5H2,(H,10,11)/t8-/m0/s1 |
| InChIKey | HMBHAQMOBKLWRX-QMMMGPOBSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 21 |
| Chiral Atom Count | 1 |
| Bond Count | 22 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 687061 |
| CCDC/CSD | BOYHED |
