| CAS Number | 1148026-99-6 |
| Catalog Number | AG00HCX0 |
| Chemical Name | Bromo-PEG3-phosphonic acid |
| IUPAC Name | 2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethylphosphonic acid |
| InChI | InChI=1S/C8H18BrO6P/c9-1-2-13-3-4-14-5-6-15-7-8-16(10,11)12/h1-8H2,(H2,10,11,12) |
| InChI Key | BZNXKXDTCPHJIY-UHFFFAOYSA-N |
| MDL Number | MFCD18383182 |
| Molecular Formula | C8H18BrO6P |
| Molecular Weight | 321.1027 |
| SMILES | BrCCOCCOCCOCCP(=O)(O)O |
| Synonyms | Bromo-PEG3-phosphonic acid,
1148026-99-6,
(2-[2-[2-(2-bromo-ethoxy)ethoxy]ethoxy]ethyl)phosphonic acid,
BIPG1342,
MFCD11982881,
ZINC44960050,
BP-21732,
(2-{2-[2-(2-Bromo-ethoxy)-ethoxy]-ethoxy}-ethyl)phosphonic acid,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 320.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 321.104g/mol |
| Monoisotopic Mass | 320.002g/mol |
| Rotatable Bond Count | 11 |
| Topological Polar Surface Area | 85.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
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Certificate of Analysis
Lot Number