| CAS Number | 2055023-35-1 |
| Catalog Number | AG019E76 |
| Chemical Name | Acid-apeg6-acid n-boc |
| IUPAC Name | 3-[2-[2-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethoxy]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]ethoxy]ethoxy]propanoic acid |
| InChI | InChI=1S/C23H43NO12/c1-23(2,3)36-22(29)24(6-10-32-14-18-34-16-12-30-8-4-20(25)26)7-11-33-15-19-35-17-13-31-9-5-21(27)28/h4-19H2,1-3H3,(H,25,26)(H,27,28) |
| InChI Key | HVRLCVIGYIBUGD-UHFFFAOYSA-N |
| MDL Number | MFCD29912757 |
| Molecular Formula | C23H43NO12 |
| Molecular Weight | 525.5870 |
| SMILES | CC(C)(C)OC(=O)N(CCOCCOCCOCCC(=O)O)CCOCCOCCOCCC(=O)O |
| Synonyms | Acid-apeg6-acid n-boc,
2055023-35-1,
N-Boc-N-bis(PEG3-acid),
BP-23247,
|
| Complexity | 546 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 525.279g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 12 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 525.592g/mol |
| Monoisotopic Mass | 525.279g/mol |
| Rotatable Bond Count | 26 |
| Topological Polar Surface Area | 160A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number