2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
C13H25BrO5 — CID 139925917
Data last refreshed: (MolForge compound catalog, from PubChem)
About 2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene (PubChem CID 139925917) has the molecular formula C13H25BrO5 and a molecular weight of 341.24 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene.
Molecular Properties
| Compound Name | 2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene |
|---|---|
| PubChem CID | 139925917 |
| Molecular Formula | C13H25BrO5 |
| Molecular Weight | 341.24 g/mol |
| Exact Mass | 340.09 |
| IUPAC Name | 2-[2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene |
| SMILES | C=C(C)OCCOCCOCCOCCOCCBr |
| InChI | InChI=1S/C13H25BrO5/c1-13(2)19-12-11-18-10-9-17-8-7-16-6-5-15-4-3-14/h1,3-12H2,2H3 |
| InChIKey | VDIYEGXIUUANNR-UHFFFAOYSA-N |
| XLogP | 2.00 |
| TPSA | 46.15 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 341.24 |
| LogP ≤ 5 | 2.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'} |
|---|
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Sources
- PubChem CID 139925917 — identifiers, structure, computed properties (public domain)
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