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DBCO-SS-aldehyde
| Catalog Number | R01-0277 |
| Category | Cycloalkyne Dyes (DBCO) |
| Molecular Formula | C28H27N3O6S2 |
| Molecular Weight | 565.66 |
| Catalog Number | Size | Price | Quantity |
|---|---|---|---|
| R01-0277 | -- | -- |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
Chemical Information
Product Specification
Computed Properties
| Purity | ≥95% |
| Shelf Life | ≥ 2 years |
| IUPAC Name | |
| Canonical SMILES | C1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCNC(=O)CCSSCCNC(=O)C4=CC=C(C=C4)C=O |
| InChI | InChI=1S/C31H29N3O4S2/c35-22-23-9-11-26(12-10-23)31(38)33-18-20-40-39-19-16-29(36)32-17-15-30(37)34-21-27-7-2-1-5-24(27)13-14-25-6-3-4-8-28(25)34/h1-12,22H,15-21H2,(H,32,36)(H,33,38) |
| InChIKey | RQSKTIYFMRQDRL-UHFFFAOYSA-N |
| Solubility | 10 mm in DMSO |
| Appearance | white foam |
| Storage | Store at -20 °C, keep in dry and avoid sunlight. |
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 12 |
| Exact Mass | 571.15994876 g/mol |
| Monoisotopic Mass | 571.15994876 g/mol |
| Topological Polar Surface Area | 146Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 939 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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