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TCO-PEG4-NHS ester

CAT: 0024-sc-498420ASize: 25 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-498420ASize:25 mg
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CAS Number
1613439-69-2

Chemical Information

TCO-PEG4-NHS (contains 6% Dichloromethane at maximum)
CAS Number1613439-69-2
PubChem CID118338101
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC24H38N2O10
Molecular Weight514.6
XLogP0.6
Topological Polar Surface Area139
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count19
Heavy Atom Count36
Formal Charge0
Complexity699
SMILES
C1C/C=C\CCC(C1)OC(=O)NCCOCCOCCOCCOCCC(=O)ON2C(=O)CCC2=O
InChI
InChI=1S/C24H38N2O10/c27-21-8-9-22(28)26(21)36-23(29)10-12-31-14-16-33-18-19-34-17-15-32-13-11-25-24(30)35-20-6-4-2-1-3-5-7-20/h1-2,20H,3-19H2,(H,25,30)/b2-1-
InChIKey
ZKPMRASGLDBKPF-UPHRSURJSA-N
Chemical Structure
2D Structure
2D structure of TCO-PEG4-NHS (contains 6% Dichloromethane at maximum)
CAS: 1613439-69-2
CID: 118338101
Formula: C24H38N2O10
MW: 514.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight514.6
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count19
Exact Mass514.25264541
Monoisotopic Mass514.25264541
Topological Polar Surface Area139 Ų
Heavy Atom Count36
Formal Charge0
Complexity699
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BUP06120-01TCO-PEG4-NHS ester
WPC09679-01TCO-PEG4-NHS ester trans-cyclooctene-PEG4-NHS ester
GTR19222367-01(E) -TCO-PEG4-NHS ester
HY-141167B(S) -TCO-PEG4-NHS ester
HY-154802TCO-GK-PEG4-NHS ester
MBS5799635(E)-TCO-PEG4-NHS ester
T17014-01TCO-NHS ester
3056-100mgTCO-PEG4-NHS ester (axial isomer), 100 mg
3056-25mgTCO-PEG4-NHS ester (axial isomer), 25 mg
3056-10mgTCO-PEG4-NHS ester (axial isomer), 10 mg

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