| CAS Number | 2112734-70-8 |
| Catalog Number | AG019EDN |
| Chemical Name | N-(Hydroxy-PEG3)-N-bis(PEG4-t-butyl ester) |
| IUPAC Name | tert-butyl 3-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl-[2-[2-[2-[2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoate |
| InChI | InChI=1S/C38H75NO16/c1-37(2,3)54-35(41)7-13-43-19-25-49-31-33-52-28-22-46-16-10-39(9-15-45-21-27-51-30-24-48-18-12-40)11-17-47-23-29-53-34-32-50-26-20-44-14-8-36(42)55-38(4,5)6/h40H,7-34H2,1-6H3 |
| InChI Key | HUNABBFTEGRMNW-UHFFFAOYSA-N |
| MDL Number | MFCD30730366 |
| Molecular Formula | C38H75NO16 |
| Molecular Weight | 801.9992 |
| SMILES | O=C(OC(C)(C)C)CCOCCOCCOCCOCCN(CCOCCOCCOCCO)CCOCCOCCOCCOCCC(=O)OC(C)(C)C |
| Synonyms | N-(Hydroxy-PEG3)-N-bis(PEG4-t-butyl ester),
2112734-70-8,
BP-23630,
|
| Complexity | 799 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 801.509g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 55 |
| Hydrogen Bond Acceptor Count | 17 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 802.009g/mol |
| Monoisotopic Mass | 801.509g/mol |
| Rotatable Bond Count | 45 |
| Topological Polar Surface Area | 178A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number