| CAS Number | 1807540-84-6 |
| Catalog Number | AG00I09D(AGN-PC-0WQXGJ) |
| Chemical Name | 2,3,5,6-Tetrafluorophenyl 19-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-17-oxo-4,7,10,13-tetraoxa-16-azanonadecanoate |
| IUPAC Name | (2,3,5,6-tetrafluorophenyl) 3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoate |
| InChI | InChI=1S/C24H28F4N2O9/c25-16-15-17(26)23(28)24(22(16)27)39-21(34)4-7-35-9-11-37-13-14-38-12-10-36-8-5-29-18(31)3-6-30-19(32)1-2-20(30)33/h1-2,15H,3-14H2,(H,29,31) |
| InChI Key | LKZRDWRFDOPKGN-UHFFFAOYSA-N |
| MDL Number | MFCD28505515 |
| Molecular Formula | C24H28F4N2O9 |
| Molecular Weight | 564.4807 |
| SMILES | O=C(OC=1C(F)=C(F)C=C(F)C1F)CCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O |
| Synonyms | Mal-amido-PEG4-TFP ester,
1807540-84-6,
MAL-dPEG(R)4-TFP ester,
BIPG1485,
ZINC230490992,
BP-22740,
|
| Complexity | 803 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 564.173g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 39 |
| Hydrogen Bond Acceptor Count | 13 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 564.487g/mol |
| Monoisotopic Mass | 564.173g/mol |
| Rotatable Bond Count | 20 |
| Topological Polar Surface Area | 130A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number