Gly-Gly-Gly-PEG3-TCO

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Gly-Gly-Gly-PEG3-TCO

Gly-Gly-Gly-PEG3-TCO | CAS 2353409-81-9

Catalog Number R15-0004
Category Trans Cyclooctene (TCO)
Molecular Formula C23H41N5O8
Molecular Weight 515.60
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Product Introduction

  • Chemical Information

  • Product Specification

  • Application

  • Computed Properties

Synonyms Cyclooct-4-en-1-yl (1-amino-6-(2-amino-2-oxoethyl)-2,5-dioxo-9,12,15-trioxa-3,6-diazaheptadecan-17-yl)carbamate
Purity ≥95%
Shelf Life 0-4°C for short term (days to weeks), or -20°C for long term (months).
IUPAC Name
Canonical SMILES C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCN(CC(=O)N)C(=O)CNC(=O)CN
InChI InChI=1S/C23H41N5O8/c24-16-21(30)27-17-22(31)28(18-20(25)29)9-11-34-13-15-35-14-12-33-10-8-26-23(32)36-19-6-4-2-1-3-5-7-19/h1-2,19H,3-18,24H2,(H2,25,29)(H,26,32)(H,27,30)/b2-1-
InChIKey HXCYFJZPQLRXDG-UPHRSURJSA-N
Solubility 10 mm in DMSO
Appearance Solid
Storage -20°C
XLogP3 -1.1
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 19
Exact Mass 515.29551328 g/mol
Monoisotopic Mass 515.29551328 g/mol
Topological Polar Surface Area 179Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 677
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

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