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Mal-PEG5-NHS ester

CAT: 0931-T15997-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T15997-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1807537-42-3
Target
Others, PROTAC Linker
Related Pathways
Others, PROTAC
Bioactivity
Mal-PEG5-NHS ester, an alkyl/ether and PEG-based PROTAC linker, is utilized for the synthesis of PROTACs.
Smiles
O=C(ON1C(=O)CCC1=O)CCOCCOCCOCCOCCOCCN2C(=O)C=CC2=O
Molecular Formula
C21H30N2O11
Molecular Weight
486.47
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mal-PEG5-NHS ester
CAS Number1807537-42-3
PubChem CID77078334
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC21H30N2O11
Molecular Weight486.5
XLogP-2.3
Topological Polar Surface Area147
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count20
Heavy Atom Count34
Formal Charge0
Complexity706
SMILES
C1CC(=O)N(C1=O)OC(=O)CCOCCOCCOCCOCCOCCN2C(=O)C=CC2=O
InChI
InChI=1S/C21H30N2O11/c24-17-1-2-18(25)22(17)6-8-30-10-12-32-14-16-33-15-13-31-11-9-29-7-5-21(28)34-23-19(26)3-4-20(23)27/h1-2H,3-16H2
InChIKey
PDFXZGGPCFZXJU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mal-PEG5-NHS ester
CAS: 1807537-42-3
CID: 77078334
Formula: C21H30N2O11
MW: 486.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight486.5
XLogP3-2.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count20
Exact Mass486.18495978
Monoisotopic Mass486.18495978
Topological Polar Surface Area147 Ų
Heavy Atom Count34
Formal Charge0
Complexity706
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
572860Mal-PEG5-NHS ester
HY-133544Mal-CO-PEG5-​NHS ester
MBS5799236Mal-CO-PEG5-?NHS ester
QCC35592-01Mal-amido-PEG5-C2-​NHS ester
OR1033807-01Mal-amido-PEG5-C2-?NHS ester
MBS5769473Mal-PEG5-PFP ester
TDC47641-01Acid-PEG5-NHS ester
HY-174892-01Biotin-PEG5-NHS ester
HY-171559TCO-PEG5-NHS ester
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