2,3-Dihydroxy-1,4-dithiobutane

Base Information

• Chemical Name: 2,3-Dihydroxy-1,4-dithiobutane
• CAS No.: 16096-97-2
• Deprecated CAS: 214119-27-4,27565-41-9,28823-08-7,1377983-58-8
• Molecular Formula: C4H10O2S2
• Molecular Weight: 154.254
• Hs Code.: 2930909090
• European Community (EC) Number: 222-468-7,240-263-0,248-531-9
• UNII: T8ID5YZU6Y
• DSSTox Substance ID: DTXSID501316708
• Nikkaji Number: J64.634B
• Wikipedia: Dithiothreitol
• Wikidata: Q27104490
• NCI Thesaurus Code: C76286
• Metabolomics Workbench ID: 148893
• ChEMBL ID: CHEMBL406270
• Mol file: 16096-97-2.mol

Synonyms:Cleland Reagent;Cleland's Reagent;Clelands Reagent;Dithiothreitol;Reagent, Cleland;Reagent, Cleland's;Sputolysin

Chemical Property of 2,3-Dihydroxy-1,4-dithiobutane

Chemical Property:

• Appearance/Colour: white crystalline powder
• Vapor Pressure: 8.68E-07mmHg at 25°C
• Melting Point: 51 °C
• Refractive Index: 26 ° (C=2.5, MeOH)
• Boiling Point: 364.453 °C at 760 mmHg
• PKA: 9.28±0.10(Predicted)
• Flash Point: 174.215 °C
• PSA: 118.06000
• Density: 1.303 g/cm³
• LogP: -0.43220
• Storage Temp.: −20°C
• Solubility.: H2O: soluble50mg/mL, clear to hazy, colorless
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 154.01222190
• Heavy Atom Count: 8
• Complexity: 52

Purity/Quality:

98%,99%, ^*data from raw suppliers

L-Dithiothreitol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 21/22-36/37/38
• Safety Statements: 26-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Uses -> Biochemical Research
• Canonical SMILES: C(C(C(CS)O)O)S
• Isomeric SMILES: C([C@@H]([C@H](CS)O)O)S
• Uses: L-DTT [(2R,3R)-1,4-dimercapto-2,3-butanediol; L-dithiothreitol], a chiral bidentate dithiol with two stereogenic centers, may be used in chiroptical response research. L-DDT is proposed as a stereoselective reducing agent for disulfide bridges in complex molecules.

Technology Process of 2,3-Dihydroxy-1,4-dithiobutane

There total 8 articles about 2,3-Dihydroxy-1,4-dithiobutane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

trans-1,2-dithiane-4,5-diol (16096-98-3) → 1,4-dithio-L-threitol (16096-97-2)

Guidance literature:

With tris-(2-carboxyethyl)-phosphine hydrochloride; potassium carbonate; In methanol; chloroform; water; at 20 ℃; for 6h;

DOI:10.3987/com-02-9603

Reference yield:

→ N,N-dimethyl-formamide (68-12-2,33513-42-7) + diothiothreitol (3483-12-3,6892-68-8,7634-42-6,16096-97-2,27565-41-9,35454-97-8)

Guidance literature:

Reference yield:

trans-4,5-dihydroxy-1,2-dithiane → diothiothreitol (3483-12-3,6892-68-8,7634-42-6,16096-97-2,27565-41-9,35454-97-8)

Guidance literature:

With C₁₂₀H₁₃₂N₁₂Ru₂S₂⁽⁴⁺⁾*4F₆P^(1-); triethylamine; In acetonitrile; at 22 ℃; Reagent/catalyst; Catalytic behavior; Irradiation;

DOI:10.1002/chem.201804037

upstream raw materials:

trans-1,2-dithiane-4,5-diol

cis-4,5-dihydroxy-1,2-dithiane

trans-1,2-dithiane-4,5-diol

Downstream raw materials:

1-aminoacridin-9(10H)-one

(5-Isopropyl-4-mercapto-2-methyl-phenoxy)-acetic acid methyl ester

2-Mercapto-N-(4-sulfamoylphenyl)benzamide

p-mercaptodihydrocinnamyl hydrazide

Refernces

• 1、 Carmack,M.,Kelley,C.J.. "-". . p. 2171 - 2173. Retrieved 1968.
• 2、 -. "Micellar systems". . . Retrieved 2008/06/13.
• 3、 -. "4-hydroxyquinoline-3-carboxamides and hydrazides as antiviral agents". . . Retrieved 2008/06/13.