3-(Dimethylamino)-1-(5-methylthiophen-2-YL)prop-2-EN-1-one

Base Information

Chemical Name:3-(Dimethylamino)-1-(5-methylthiophen-2-YL)prop-2-EN-1-one
CAS No.:90815-53-5
Molecular Formula:C₁₀H₁₃NOS
Molecular Weight:195.285
Hs Code.:
DSSTox Substance ID:DTXSID50559215
Wikidata:Q82441867
Mol file:90815-53-5.mol

Synonyms:3-(DIMETHYLAMINO)-1-(5-METHYLTHIOPHEN-2-YL)PROP-2-EN-1-ONE;90815-53-5;(E)-3-(dimethylamino)-1-(5-methylthiophen-2-yl)prop-2-en-1-one;SCHEMBL7476495;DTXSID50559215;AKOS003604384;CS-0289587;EN300-1125892;(2E)-3-(Dimethylamino)-1-(5-methylthiophen-2-yl)prop-2-en-1-one;(e)-3-(dimethylamino)-1-(5-methylthiophene-2-yl)prop-2-en-1-one

Suppliers and Price of 3-(Dimethylamino)-1-(5-methylthiophen-2-YL)prop-2-EN-1-one

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 5 raw suppliers

Chemical Property of 3-(Dimethylamino)-1-(5-methylthiophen-2-YL)prop-2-EN-1-one

Chemical Property:

PSA：48.55000
LogP:2.31450
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:195.07178521
Heavy Atom Count:13
Complexity:213

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(S1)C(=O)C=CN(C)C
Isomeric SMILES:CC1=CC=C(S1)C(=O)/C=C/N(C)C

Technology Process of 3-(Dimethylamino)-1-(5-methylthiophen-2-YL)prop-2-EN-1-one

There total 2 articles about 3-(Dimethylamino)-1-(5-methylthiophen-2-YL)prop-2-EN-1-one 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: 41.0%

: 13679-74-8
2-Acetyl-5-methylthiophen

: 94815-01-7
N-Dimethoxymethyl-N',N'-dimethylformamidin

: 90815-53-5
(E)-3-(dimethylamino)-1-(5-methylthiophene-2-yl)prop-2-en-1-one

Guidance literature:: In isopropyl alcohol; for 4.5h; Heating;
DOI:10.1007/s10593-006-0154-7

Reference yield: 39.0%

: 13679-74-8
2-Acetyl-5-methylthiophen

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: 90815-53-5
(E)-3-(dimethylamino)-1-(5-methylthiophene-2-yl)prop-2-en-1-one

Guidance literature:: 2-Acetyl-5-methylthiophen; N,N-dimethyl-formamide dimethyl acetal; for 1h; Cooling with ice;

at 110 ℃; for 8h;
DOI:10.1007/s11224-016-0863-1

Reference yield:

: 90815-53-5
(E)-3-(dimethylamino)-1-(5-methylthiophene-2-yl)prop-2-en-1-one

: 931114-16-8
(5-methyl-thiophen-2-yl)-[7-(3-nitro-phenyl)-pyrazolo[1,5-a]pyrimidin-3-yl]-methanone

Guidance literature:: Multi-step reaction with 4 steps

1: hydroxylamine hydrochloride / 3 h / Heating

2: 18 h / Heating

3: hydrazine hydrate

4: acetic acid / Heating

With hydroxylamine hydrochloride; hydrazine hydrate; acetic acid;
DOI:10.1016/j.bmcl.2006.12.116