(2,5-Dimethoxy-1,4-phenylene)dimethanethiol

Base Information

• Chemical Name: (2,5-Dimethoxy-1,4-phenylene)dimethanethiol
• CAS No.: 50874-28-7
• Molecular Formula: C10H14O2S2
• Molecular Weight: 230.352
• DSSTox Substance ID: DTXSID40497233
• Nikkaji Number: J184.522E
• Wikidata: Q63396470
• Mol file: 50874-28-7.mol

Synonyms:50874-28-7;(2,5-Dimethoxy-1,4-phenylene)dimethanethiol;1,4-Benzenedimethanethiol, 2,5-dimethoxy-;SCHEMBL11826603;DTXSID40497233;ZEDHECWYZXVVDM-UHFFFAOYSA-N;2,5-dimethoxy-1,4-bis(thiomethyl)benzene;(2,5-dimethoxybenzene-1,4-diyl)dimethanethiol;1,4-BIS(MERCAPTOMETHYL)-2,5-DIMETHOXYBENZENE;Q63396470

Chemical Property of (2,5-Dimethoxy-1,4-phenylene)dimethanethiol

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 230.04352203
• Heavy Atom Count: 14
• Complexity: 148

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1CS)OC)CS

Technology Process of (2,5-Dimethoxy-1,4-phenylene)dimethanethiol

There total 3 articles about (2,5-Dimethoxy-1,4-phenylene)dimethanethiol 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: 49.0%

1,4-bis(chloromethyl)-2,5-dimethoxybenzene (3752-97-4) → 2,5-dimethoxy-1,4-bis(mercaptomethyl)benzene (50874-28-7)

Guidance literature:

1,4-bis(chloromethyl)-2,5-dimethoxybenzene; With thiourea; In acetone; for 4h; Heating;

With sodium hydroxide; at 80 ℃; for 7h; Further stages.;

DOI:10.1039/b802178c

Reference yield: 28.0%

1,4-bis(bromomethyl)-2,5-dimethoxybenzene (50874-27-6) + thiourea (17356-08-0) → 2,5-dimethoxy-1,4-bis(mercaptomethyl)benzene (50874-28-7)

Guidance literature:

1,4-bis(bromomethyl)-2,5-dimethoxybenzene; thiourea; In tetrahydrofuran; ethanol; Reflux;

With sodium hydroxide; In tetrahydrofuran; ethanol; water; Reflux;

DOI:10.1039/c1ob05319a

Reference yield:

→ 2,5-dimethoxy-1,4-bis(mercaptomethyl)benzene (50874-28-7)

Guidance literature:

upstream raw materials:

1,4-bis(chloromethyl)-2,5-dimethoxybenzene

1,4-bis(bromomethyl)-2,5-dimethoxybenzene

thiourea

Downstream raw materials:

4,7-Dimethoxy-12,15-dinitro<2,2>paracyclophan

C₁₀H₁₂As₂Cl₄O₂S₂

4,7-dimethoxy<2.2>paracyclophane

5,8,12,15-Tetramethoxy<2.2>metaparacyclophane