3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)-

Base Information

Chemical Name:3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)-
CAS No.:89070-54-2
Molecular Formula:C₁₃H₁₃NO
Molecular Weight:199.252
Hs Code.:
DSSTox Substance ID:DTXSID70528180
Wikidata:Q82397591

Synonyms:89070-54-2;3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)-;DTXSID70528180;1-(3-Methyl-1H-indol-1-yl)but-3-en-2-one;1-(3-METHYLINDOL-1-YL)BUT-3-EN-2-ONE

Suppliers and Price of 3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)-

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

AccelPharmtech
1-(3-methyl-1H-indol-1-yl)-3-Buten-2-one 97.00%
25G
$ 8510.00

AccelPharmtech
1-(3-methyl-1H-indol-1-yl)-3-Buten-2-one 97.00%
5G
$ 4530.00

AccelPharmtech
1-(3-methyl-1H-indol-1-yl)-3-Buten-2-one 97.00%
1G
$ 2640.00

Total 1 raw suppliers

Chemical Property of 3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)-

Chemical Property:

PSA：22.00000
LogP:2.70480
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:199.099714038
Heavy Atom Count:15
Complexity:261

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

1-(3-methyl-1H-indol-1-yl)-3-Buten-2-one 97.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CN(C2=CC=CC=C12)CC(=O)C=C

Technology Process of 3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)-

There total 3 articles about 3-Buten-2-one, 1-(3-methyl-1H-indol-1-yl)- 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: 7.0%

: 89059-08-5
1-diazo-4(3-methylindol-1-yl)-2-butanone

: 89070-54-2
4-(3-methylindol-1-yl)but-1-en-3-one

: 1-methylbenzo(b)-5,6-dihydroindolizin-7(8H)-one

Guidance literature:: With copper; In benzene; for 2.5h; Heating;
DOI:10.1002/hlca.19830660835

Reference yield:

: 83-34-1
3-Methylindole

: 89070-54-2
4-(3-methylindol-1-yl)but-1-en-3-one

Guidance literature:: Multi-step reaction with 3 steps

1: 50 percent

2: 1.) N-methylmorpholine / 1.) Et₂O; 2.) Et₂O, 20 deg C, 4 h

3: 24 percent / Cu / benzene / 2.5 h / Heating

With 4-methyl-morpholine; copper; In benzene;
DOI:10.1002/hlca.19830660835

Reference yield:

: 57662-47-2
3-(3-methylindol-1-yl)propanoic acid

: 89070-54-2
4-(3-methylindol-1-yl)but-1-en-3-one

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) N-methylmorpholine / 1.) Et₂O; 2.) Et₂O, 20 deg C, 4 h

2: 24 percent / Cu / benzene / 2.5 h / Heating

With 4-methyl-morpholine; copper; In benzene;
DOI:10.1002/hlca.19830660835