4-Dibenzo[b,d]thien-2-yl-4-oxobutanoic acid

Base Information

Chemical Name:4-Dibenzo[b,d]thien-2-yl-4-oxobutanoic acid
CAS No.:88878-79-9
Molecular Formula:C16H12O3S
Molecular Weight:284.3297
Hs Code.:
European Community (EC) Number:684-924-5
NSC Number:105900
DSSTox Substance ID:DTXSID10295864
Wikidata:Q82036059
ChEMBL ID:CHEMBL1440219

Synonyms:NSC105900;88878-79-9;MLS002703854;NSC-105900;4-dibenzo[b,d]thien-2-yl-4-oxobutanoic acid;NCIStruc1_000817;NCIStruc2_000881;SCHEMBL7823639;CHEMBL1440219;DTXSID10295864;CCG-36262;NCGC00014079;NCI105900;AKOS024331808;NCGC00014079-02;NCGC00097188-01;NCI60_000143;SMR001570568

Suppliers and Price of 4-Dibenzo[b,d]thien-2-yl-4-oxobutanoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of 4-Dibenzo[b,d]thien-2-yl-4-oxobutanoic acid

Chemical Property:

Vapor Pressure:8.5E-13mmHg at 25°C
Boiling Point:547°C at 760 mmHg
Flash Point:284.6°C
Density:1.378g/cm³
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:284.05071541
Heavy Atom Count:20
Complexity:395

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C(=O)CCC(=O)O

Technology Process of 4-Dibenzo[b,d]thien-2-yl-4-oxobutanoic acid

There total 8 articles about 4-Dibenzo[b,d]thien-2-yl-4-oxobutanoic acid 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: 47.0%

: 108-30-5
succinic acid anhydride

: 132-65-0
dibenzothiophene

: 88878-79-9
β-(dibenzothiophene-2-carbonyl)propionic acid

Guidance literature:: With aluminum (III) chloride; In nitrobenzene; 1,2-dichloro-ethane; at 0 - 60 ℃; for 5.5h; Inert atmosphere; Sealed tube;
DOI:10.1111/php.13175

Reference yield:

: 132-65-0
dibenzothiophene

1,1,2,2-tetracholorethane: 1,1,2,2-tetracholorethane

: 88878-79-9
β-(dibenzothiophene-2-carbonyl)propionic acid

Guidance literature:: aluminium trichloride; In sodium hydroxide; nitrobenzene;

Reference yield:

: 22439-58-3
2-acetyldibenzothiophene

: 88878-79-9
β-(dibenzothiophene-2-carbonyl)propionic acid

Guidance literature:: Multi-step reaction with 2 steps

1: bromine; hydrogen chloride; diethyl ether / Belichtung

2: benzene / Erwaermen des Reaktionsprodukts mit aethanol. Kalilauge und Erhitzen der erhaltenen Dicarbonsaeure auf 160grad

With hydrogenchloride; diethyl ether; bromine; benzene;
DOI:10.1021/jo01214a004