| CAS Number | 1807512-39-5 |
| Catalog Number | AG00I07F(AGN-PC-0WR1OA) |
| Chemical Name | P-3,6,9,12,15-Pentaoxahexadec-1-ylphosphonic acid |
| IUPAC Name | 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethylphosphonic acid |
| InChI | InChI=1S/C11H25O8P/c1-15-2-3-16-4-5-17-6-7-18-8-9-19-10-11-20(12,13)14/h2-11H2,1H3,(H2,12,13,14) |
| InChI Key | RCTDZLSRRJVKHJ-UHFFFAOYSA-N |
| MDL Number | MFCD28505503 |
| Molecular Formula | C11H25O8P |
| Molecular Weight | 316.2852 |
| SMILES | C(COCCOCCOCCOCCOC)P(O)(O)=O |
| Synonyms | m-PEG5-phosphonic acid,
1807512-39-5,
BIPG1636,
ZINC230490804,
BP-22758,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 316.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 316.287g/mol |
| Monoisotopic Mass | 316.129g/mol |
| Rotatable Bond Count | 15 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number