Azidoethyl-SS-propionic acid

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Azidoethyl-SS-propionic acid

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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