| CAS Number | 1334178-03-8 |
| Catalog Number | AG019EA9 |
| Chemical Name | Nhs-dpeg(r)4-m-dpeg(r)12)3-ester |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 5-[2-[2-[2-[2-[3-[[1,3-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2-[[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]methyl]propan-2-yl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethylamino]-5-oxopentanoate |
| InChI | InChI=1S/C108H206N6O52/c1-123-25-28-131-41-44-139-55-58-145-67-70-151-79-82-157-91-94-160-88-85-154-76-73-148-64-61-142-52-49-136-38-33-128-22-14-110-101(116)9-18-163-97-108(113-104(119)12-17-126-31-36-134-47-48-135-37-32-127-21-13-109-100(115)5-4-6-107(122)166-114-105(120)7-8-106(114)121,98-164-19-10-102(117)111-15-23-129-34-39-137-50-53-143-62-65-149-74-77-155-86-89-161-95-92-158-83-80-152-71-68-146-59-56-140-45-42-132-29-26-124-2)99-165-20-11-103(118)112-16-24-130-35-40-138-51-54-144-63-66-150-75-78-156-87-90-162-96-93-159-84-81-153-72-69-147-60-57-141-46-43-133-30-27-125-3/h4-99H2,1-3H3,(H,109,115)(H,110,116)(H,111,117)(H,112,118)(H,113,119) |
| InChI Key | VOPFWBJWEJMWRQ-UHFFFAOYSA-N |
| MDL Number | MFCD16621418 |
| Molecular Formula | C108H206N6O52 |
| Molecular Weight | 2420.8002 |
| SMILES | COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCOCC(NC(=O)CCOCCOCCOCCOCCNC(=O)CCCC(=O)ON1C(=O)CCC1=O)(COCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)COCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC |
| Synonyms | NHS-PEG4-(PEG12)3,
NHS-PEG4-(m-PEG12)3-ester,
Monodisperse branched PEG-NHS-ester,
NHS-PEG4-( m-PEG12)3-ester,
MFCD16621418,
BP-23454,
NHS-dPEG(R)4-( m-dPEG(R)12)3-ester,
NHS-PEG4-(PEG12)3, >=90% (HPLC),
1334178-03-8,
|
| Complexity | 3000 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 2420.369g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 166 |
| Hydrogen Bond Acceptor Count | 52 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 2420.826g/mol |
| Monoisotopic Mass | 2419.366g/mol |
| Rotatable Bond Count | 145 |
| Topological Polar Surface Area | 606A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -10.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number