A1D6Y
Summary
| Name: | 2-ethoxycarbonylbenzoic acid |
| Synonyms: | monoethyl phthalate |
| Formula: | C10 H10 O4 |
| Formal charge: | 0 |
| Formula weight: | 194.184 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-ethoxycarbonylbenzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H10O4/c1-2-14-10(13)8-6-4-3-5-7(8)9(11)12/h3-6H,2H2,1H3,(H,11,12) |
| InChIKey | InChI | 1.06 | YWWHKOHZGJFMIE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)c1ccccc1C(O)=O |
| SMILES | CACTVS | 3.385 | CCOC(=O)c1ccccc1C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1ccccc1C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1ccccc1C(=O)O |
