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MPEG8-NHS

CAT: 0926-FM72946-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-FM72946-02Size:250 mg
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CAS Number
1316189-13-5
Smiles
COCCOCCOCCOCCOCCOCCOCCOCCOCCC (=O) ON1C (=O) CCC1=O
Molecular Formula
C24H43NO13
Molecular Weight
553.6 g/mol
Controlled
No

Chemical Information

m-PEG9-NHS ester
CAS Number1316189-13-5
PubChem CID91757806
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC24H43NO13
Molecular Weight553.6
XLogP-2.2
Topological Polar Surface Area147
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count29
Heavy Atom Count38
Formal Charge0
Complexity592
SMILES
COCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C24H43NO13/c1-29-6-7-31-10-11-33-14-15-35-18-19-37-21-20-36-17-16-34-13-12-32-9-8-30-5-4-24(28)38-25-22(26)2-3-23(25)27/h2-21H2,1H3
InChIKey
PHNXKFXTQIHOCL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of m-PEG9-NHS ester
CAS: 1316189-13-5
CID: 91757806
Formula: C24H43NO13
MW: 553.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight553.6
XLogP3-2.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count29
Exact Mass553.27344043
Monoisotopic Mass553.27344043
Topological Polar Surface Area147 Ų
Heavy Atom Count38
Formal Charge0
Complexity592
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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