3-(Chloromethyl)thiophene

Base Information

• Chemical Name: 3-(Chloromethyl)thiophene
• CAS No.: 2746-23-8
• Molecular Formula: C5H5ClS
• Molecular Weight: 132.614
• Hs Code.: 2934999090
• European Community (EC) Number: 821-466-9
• DSSTox Substance ID: DTXSID90500084
• Nikkaji Number: J793.363K
• Wikidata: Q72455375
• Mol file: 2746-23-8.mol

Synonyms:3-(chloromethyl)thiophene;2746-23-8;3-Chloromethyl-thiophene;MFCD08445657;3-Chloromethylthiophene;Thiophene, 3-(chloromethyl)-;3-thenyl chloride;3-chloromethyl thiophene;SCHEMBL168516;DTXSID90500084;KKWWFYAKOFXBEY-UHFFFAOYSA-N;GEO-04405;AKOS000262234;AT17055;SB36336;AM100610;BS-28102;4-CHLORO-2-PHENYLAMINO-BENZOICACID;FT-0753221;EN300-43582;A876928;J-510846

Chemical Property of 3-(Chloromethyl)thiophene

Chemical Property:

• Vapor Pressure: 1.069mmHg at 25°C
• Refractive Index: 1.559
• Boiling Point: 183.1 °C at 760 mmHg
• Flash Point: 80.1 °C
• PSA: 28.24000
• Density: 1.243 g/cm³
• LogP: 2.48690
• Storage Temp.: 2-8°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 131.9800490
• Heavy Atom Count: 7
• Complexity: 56

Purity/Quality:

97% ^*data from raw suppliers

3-(Chloromethyl)thiophene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CSC=C1CCl

Technology Process of 3-(Chloromethyl)thiophene

There total 10 articles about 3-(Chloromethyl)thiophene 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: 91.0%

→ 3-(chloromethyl)thiophene (2746-23-8)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 0 - 20 ℃;

Reference yield: 80.0%

3-hydroxymethyl-thiophene (71637-34-8) → 3-(chloromethyl)thiophene (2746-23-8)

Guidance literature:

With thionyl chloride; In dichloromethane; at 0 - 20 ℃; for 1h;

Reference yield: 71.0%

N,N-dimethyl-1-(thiophen-3-yl)methanamine (22601-13-4) → 3-(chloromethyl)thiophene (2746-23-8)

Guidance literature:

With chloroformic acid ethyl ester; In chloroform; at 0 ℃; for 0.5h; Inert atmosphere; Schlenk technique;

DOI:10.1021/ol500790p

upstream raw materials:

N-chloro-succinimide

3-Methylthiophene

3-hydroxymethyl-thiophene

3-thiophene carboxaldehyde

Downstream raw materials:

3-[4-Methyl-2-(toluene-4-sulfonyl)-pent-3-enyl]-thiophene

3-[4-Methyl-2-(toluene-4-sulfonyl)-pentyl]-thiophene

(3-thienyl)-p-toluenesulfonyl methane

2-hydroxy-4-(thien-3-ylmethoxy)acetophenone