1,4-Dithioerythritol (DTE)

Chemical Information
Dithioerythritol is the meso-diastereomer of 1,4-dimercaptobutane-2,3-diol; a sulfur-containing sugar derived from the monosaccharide erythrose; and an epimer of dithiothreitol. It has a role as a reducing agent.
| CAS Number | 6892-68-8 |
| PubChem CID | 439352 |
| IUPAC Name | (2R,3S)-1,4-bis(sulfanyl)butane-2,3-diol |
| Molecular Formula | C4H10O2S2 |
| Molecular Weight | 154.3 |
| XLogP | -0.4 |
| Topological Polar Surface Area | 42.5 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 52 |
| Property | Value |
|---|---|
| Molecular Weight | 154.3 |
| XLogP3 | -0.4 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 154.01222190 |
| Monoisotopic Mass | 154.01222190 |
| Topological Polar Surface Area | 42.5 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 52 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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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