| CAS Number | 2055013-52-8 |
| Catalog Number | AG019E09 |
| Chemical Name | Tri(Amino-PEG5-amide)-amine |
| IUPAC Name | 3-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-[2-[bis[2-[3-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]ethyl]amino]ethyl]propanamide |
| InChI | InChI=1S/C45H93N7O18/c46-4-16-59-22-28-65-34-40-68-37-31-62-25-19-56-13-1-43(53)49-7-10-52(11-8-50-44(54)2-14-57-20-26-63-32-38-69-41-35-66-29-23-60-17-5-47)12-9-51-45(55)3-15-58-21-27-64-33-39-70-42-36-67-30-24-61-18-6-48/h1-42,46-48H2,(H,49,53)(H,50,54)(H,51,55) |
| InChI Key | CMUGXZWNMJJZQZ-UHFFFAOYSA-N |
| MDL Number | MFCD31692191 |
| Molecular Formula | C45H93N7O18 |
| Molecular Weight | 1020.256 |
| SMILES | NCCOCCOCCOCCOCCOCCC(=O)NCCN(CCNC(=O)CCOCCOCCOCCOCCOCCN)CCNC(=O)CCOCCOCCOCCOCCOCCN |
| Synonyms | Tri(Amino-PEG5-amide)-amine,
2055013-52-8,
Tri(Amino-PEG5-amide)-amine TFA salt,
BP-22369,
|
| Complexity | 974 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 1019.658g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 70 |
| Hydrogen Bond Acceptor Count | 22 |
| Hydrogen Bond Donor Count | 6 |
| Isotope Atom Count | 0 |
| Molecular Weight | 1020.27g/mol |
| Monoisotopic Mass | 1019.658g/mol |
| Rotatable Bond Count | 60 |
| Topological Polar Surface Area | 307A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number