| CAS Number | 187848-68-6 |
| Catalog Number | AG00AMT4(AGN-PC-0QGXU5) |
| Chemical Name | Polyethylene glycol 2-(tert-butoxycarbonylamino)ethyl 2-carboxylethyl ether |
| IUPAC Name | 3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid |
| InChI | InChI=1S/C32H63NO16/c1-32(2,3)49-31(36)33-5-7-38-9-11-40-13-15-42-17-19-44-21-23-46-25-27-48-29-28-47-26-24-45-22-20-43-18-16-41-14-12-39-10-8-37-6-4-30(34)35/h4-29H2,1-3H3,(H,33,36)(H,34,35) |
| InChI Key | QMJVJXMTYZIZKH-UHFFFAOYSA-N |
| MDL Number | MFCD13185149 |
| Molecular Formula | C80H159NO40 |
| Molecular Weight | 1775.1012 |
| SMILES | CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(O)=O |
| Synonyms | BocNH-PEG12-CH2CH2COOH,
187848-68-6,
Boc-NH-PEG12-CH2CH2COOH,
1415981-79-1,
Boc-nh-peg(12)-cooh,
t-Boc-N-amido-PEG12-acid,
SCHEMBL12238318,
MFCD13185149,
t-boc-N-amido-PEG12-propionic acid,
ZINC97945834,
AKOS030213562,
BP-21639,
alpha-t-Butyloxycarbonylamino-omega-carboxy dodeca(ethylene glycol),
O-[2-(Boc-amino)ethyl]-Omu-(2-carboxyethyl)polyethylene glycol 3,000,
QMJVJXMTYZIZKH-UHFFFAOYSA-N,
|
| Complexity | 713 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 717.415g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 49 |
| Hydrogen Bond Acceptor Count | 16 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 717.847g/mol |
| Monoisotopic Mass | 717.415g/mol |
| Rotatable Bond Count | 41 |
| Topological Polar Surface Area | 186A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P261-P280-P301+P312-P302+P352-P305+P351+P338
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number