TCO-PEG4-NHS ester

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TCO-PEG4-NHS ester

TCO-PEG4-NHS ester | 1613439-69-2

Catalog Number R15-0045
Category TCO
Molecular Formula C24H38N2O10
Molecular Weight 514.57
Catalog Number Size Price Quantity
R15-0045 -- $--

Chemical Information

Synonyms TCO PEG4 succinimidyl ester; 2,5-dioxopyrrolidin-1-yl (E)-1-(cyclooct-4-en-1-yloxy)-1-oxo-5,8,11,14-tetraoxa-2-azaheptadecan-17-oate
Purity >99.5%
Shelf Life 0-4°C for short term (days to weeks), or -20°C for long term (months).
Canonical SMILES C1CC=CCCC(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+
InChI Key ZKPMRASGLDBKPF-OWOJBTEDSA-N
Solubility 10 mm in DMSO
Density 1.2±0.1 g/cm3
Appearance Solid
LogP -0.09
  • Product Specification
Storage -20°C
Signal Danger
GHS Hazard Statements H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity] H350 (100%): May cause cancer [Danger Carcinogenicity] H371 (100%): May cause damage to organs [Warning Specific target organ toxicity, single exposure] H373 (100%): Causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure] H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes P203, P260, P264, P270, P273, P280, P281, P308+P316, P318, P319, P405, and P501 (The corresponding statement to each P-code can be found at the GHS Classification page.)

Computed Properties

XLogP3 0.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 19
Exact Mass 514.25264541 g/mol
Monoisotopic Mass 514.25264541 g/mol
Topological Polar Surface Area 139Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 699
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
EP-2913674-A1 Stepwise assembled capture compounds comprising a cleavable function and method for isolating and/or characterizing biomolecules or biomolecule fragments, in particular proteins or protein fragments, of complex mixtures 2014-02-28
US-2016349268-A1 Stepwise assembled capture compounds comprising a cleavable function and method for isolating and/or characterizing biomolecules or biomolecule fragments, in particular proteins or protein fragments, of complex mixtures 2014-01-28
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