(4-Bromophenyl)(thiophen-2-yl)methanone

Base Information

• Chemical Name: (4-Bromophenyl)(thiophen-2-yl)methanone
• CAS No.: 4160-65-0
• Molecular Formula: C11H7BrOS
• Molecular Weight: 267.146
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20547664
• Nikkaji Number: J731.459K
• Wikidata: Q82426013
• Mol file: 4160-65-0.mol

Synonyms:(4-bromophenyl)(thiophen-2-yl)methanone;4160-65-0;(4-bromophenyl)-thiophen-2-ylmethanone;MFCD09891233;(4-Bromophenyl)-(2-thienyl)methanone;SCHEMBL4420563;AMY5362;DTXSID20547664;DDUPBKRQEURUSF-UHFFFAOYSA-N;CS1413;(4-bromophenyl)(thien-2-yl)methanone;AKOS008967471;AC-31247;AS-46520

Chemical Property of (4-Bromophenyl)(thiophen-2-yl)methanone

Chemical Property:

• PSA: 45.31000
• LogP: 3.74160
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 265.94010
• Heavy Atom Count: 14
• Complexity: 211

Purity/Quality:

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

(4-Bromophenyl)(thiophen-2-yl)methanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CSC(=C1)C(=O)C2=CC=C(C=C2)Br

Technology Process of (4-Bromophenyl)(thiophen-2-yl)methanone

There total 14 articles about (4-Bromophenyl)(thiophen-2-yl)methanone 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: 95.0%

thiophene (188290-36-0,8014-23-1,25233-34-5) + 4-chlorobenzoyl chloride (586-75-4) → (4-bromophenyl)(thien-2-yl)methanone (4160-65-0)

Guidance literature:

With aluminum (III) chloride; In dichloromethane; at 0 - 20 ℃; for 2h; Inert atmosphere; Schlenk technique;

DOI:10.1002/ejoc.201403297

Reference yield: 80.0%

2-[α-(4-bromophenyl)-α-hydroxymethyl]thiophene (40310-36-9) → (4-bromophenyl)(thien-2-yl)methanone (4160-65-0)

Guidance literature:

With pyridinium chlorochromate; In dichloromethane; at 20 ℃; for 0.5h;

Reference yield: 80.0%

2-thienyl lithium (2786-07-4) + 4-(pyrrolidinocarbonyl)phenyl bromide (5543-27-1) → (4-bromophenyl)(thien-2-yl)methanone (4160-65-0)

Guidance literature:

at 20 ℃; for 0.0166667h;

DOI:10.1002/chem.202004840

upstream raw materials:

thiophene

4-chlorobenzoyl chloride

4-Bromobenzoic acid

2-[α-(4-bromophenyl)-α-hydroxymethyl]thiophene

Downstream raw materials:

(4-bromophenyl)(5-(2-nitrophenyl)thiophen-2-yl)methanone

1-methyl-5-[4-(thien-2-yl-carbonyl)phenyl]-1H-pyrrole-2-carbonitrile

3-[4-(thiophene-2-carbonyl)-phenyl]-5-isobutyl-N-tert-butylthiophene-2-sulfonamide

(thiophen-3-yl)(4-vinylphenyl)methanone

Refernces

• 1、 Ghinato, Simone,Territo, Davide,Maranzana, Andrea,Capriati, Vito,Blangetti, Marco,Prandi, Cristina. "A Fast and General Route to Ketones from Amides and Organolithium Compounds under Aerobic Conditions: Synthetic and Mechanistic Aspects". supporting information. p. 2868 - 2874. Retrieved 2021/01/21.
• 2、 -. "Lysosome targeted photosensitizer, synthesis method and application in biological imaging". Paragraph 0042-0044; 0049. . Retrieved 2020/12/15.