C8X
Summary
| Name: | bis(2-hydroxyethyl) benzene-1,4-dicarboxylate |
| Synonyms: | bis(2-hydroxyethyl) terephthalate |
| Formula: | C12 H14 O6 |
| Formal charge: | 0 |
| Formula weight: | 254.236 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | bis(2-hydroxyethyl) benzene-1,4-dicarboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H14O6/c13-5-7-17-11(15)9-1-2-10(4-3-9)12(16)18-8-6-14/h1-4,13-14H,5-8H2 |
| InChIKey | InChI | 1.03 | QPKOBORKPHRBPS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCOC(=O)c1ccc(cc1)C(=O)OCCO |
| SMILES | CACTVS | 3.385 | OCCOC(=O)c1ccc(cc1)C(=O)OCCO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C(=O)OCCO)C(=O)OCCO |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C(=O)OCCO)C(=O)OCCO |
