DBCO-PEG4-SS-TCO

What We Offer

DBCO-PEG4-SS-TCO

DBCO-PEG4-SS-TCO

Catalog Number R01-0293
Category Cycloalkyne Dyes (DBCO)
Molecular Formula C43H58N4O9S2
Molecular Weight 839.07
Catalog Number Size Price Quantity
R01-0293 -- $--

Chemical Information

Purity ≥95%
Shelf Life ≥ 2 years
Canonical SMILES C1CC=CCCC(C1)OC(=O)NCCSSCCNC(=O)CCOCCOCCOCCOCCNC(=O)CCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C42
InChI InChI=1S/C43H58N4O9S2/c48-40(18-19-42(50)47-34-37-12-7-6-10-35(37)16-17-36-11-8-9-15-39(36)47)44-21-25-53-27-29-55-31-30-54-28-26-52-24-20-41(49)45-22-32-57-58-33-23-46-43(51)56-38-13-4-2-1-3-5-14-38/h1-2,6-12,15,38H,3-5,13-14,18-34H2,(H,44,48)(H,45,49)(H,46,51)/b2-1+/t38-/m1/s1
InChI Key PLNJLVRXRBJPOE-FXUJNMGCSA-N
Solubility 10 mm in DMSO
Appearance Light yellow oil
  • Product Specification
Storage Store at -5°C,keep in dry and avoid sunlight.

Computed Properties

XLogP3 3.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 27
Exact Mass 838.36452179 g/mol
Monoisotopic Mass 838.36452179 g/mol
Topological Polar Surface Area 204Ų
Heavy Atom Count 58
Formal Charge 0
Complexity 1310
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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