| CAS Number | 1807503-90-7 |
| Catalog Number | AG00I073(AGN-PC-0WR1QX) |
| Chemical Name | Ald-ph-peg2-nhboc |
| IUPAC Name | tert-butyl N-[2-[2-[2-[(4-formylbenzoyl)amino]ethoxy]ethoxy]ethyl]carbamate |
| InChI | InChI=1S/C19H28N2O6/c1-19(2,3)27-18(24)21-9-11-26-13-12-25-10-8-20-17(23)16-6-4-15(14-22)5-7-16/h4-7,14H,8-13H2,1-3H3,(H,20,23)(H,21,24) |
| InChI Key | MSCITXKKGMUNOD-UHFFFAOYSA-N |
| MDL Number | MFCD28155208 |
| Molecular Formula | C19H28N2O6 |
| Molecular Weight | 380.4354 |
| SMILES | CC(C)(C)OC(=O)NCCOCCOCCNC(=O)c1ccc(cc1)C=O |
| Synonyms | Ald-Ph-PEG2-NHBoc,
1807503-90-7,
BIPG1021,
ZINC220112959,
BP-22382,
|
| Complexity | 456 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 380.195g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 380.441g/mol |
| Monoisotopic Mass | 380.195g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 103A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number