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Azidoethyl-SS-propionic acid | CAS 2228857-32-5
Catalog Number | R14-0025 |
Category | Azides |
Molecular Formula | C5H9N3O2S2 |
Molecular Weight | 207.27 |
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Product Introduction
Chemical Information
Product Specification
Computed Properties
Synonyms | 3-[(2-azidoethyl)disulfanyl]propanoic acid |
Purity | >98.0% |
Shelf Life | 0-4°C for short term (days to weeks), or -20°C for long term (months). |
IUPAC Name | |
Canonical SMILES | C(CSSCCN=[N+]=[N-])C(=O)O |
InChI | InChI=1S/C5H9N3O2S2/c6-8-7-2-4-12-11-3-1-5(9)10/h1-4H2,(H,9,10) |
InChIKey | MIOCIBNCOQTVOB-UHFFFAOYSA-N |
Solubility | 10 mm in DMSO |
Appearance | Solid |
Storage | Store at -5°C,keep in dry and avoid sunlight. |
XLogP3 | 1.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 7 |
Exact Mass | 207.01361889 g/mol |
Monoisotopic Mass | 207.01361889 g/mol |
Topological Polar Surface Area | 102Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 182 |
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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