A1EML
Summary
| Name: | 3-[2-[2-[2-(3-hydroxy-3-oxopropyloxy)ethoxy]ethoxy]ethoxy]propanoic acid |
| Synonyms: | Bis-PEG4-acid |
| Formula: | C12 H22 O8 |
| Formal charge: | 0 |
| Formula weight: | 294.298 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-[2-[2-[2-(3-hydroxy-3-oxopropyloxy)ethoxy]ethoxy]ethoxy]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H22O8/c13-11(14)1-3-17-5-7-19-9-10-20-8-6-18-4-2-12(15)16/h1-10H2,(H,13,14)(H,15,16) |
| InChIKey | InChI | 1.06 | LGEVPLDBBPWJIC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CCOCCOCCOCCOCCC(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)CCOCCOCCOCCOCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(COCCOCCOCCOCCC(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(COCCOCCOCCOCCC(=O)O)C(=O)O |
