Benzene, 4-ethynyl-1-methyl-2-nitro-

Base Information

Chemical Name:Benzene, 4-ethynyl-1-methyl-2-nitro-
CAS No.:676260-08-5
Molecular Formula:C9H7NO2
Molecular Weight:161.16
Hs Code.:
DSSTox Substance ID:DTXSID10460797
Nikkaji Number:J2.028.541I
Wikidata:Q82284948

Synonyms:676260-08-5;Benzene, 4-ethynyl-1-methyl-2-nitro-;4-ethynyl-1-methyl-2-nitrobenzene;4-ethynyl-1-methyl-2-nitro-benzene;SCHEMBL8296529;DTXSID10460797;F84526;EN300-1855875;A1-02135

Suppliers and Price of Benzene, 4-ethynyl-1-methyl-2-nitro-

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 4 raw suppliers

Chemical Property of Benzene, 4-ethynyl-1-methyl-2-nitro-

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:161.047678466
Heavy Atom Count:12
Complexity:222

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=C(C=C1)C#C)[N+](=O)[O-]

Technology Process of Benzene, 4-ethynyl-1-methyl-2-nitro-

There total 1 articles about Benzene, 4-ethynyl-1-methyl-2-nitro- 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: 83.0%

: 31680-07-6
4-methyl-3-nitrobenzaldehyde

: 676260-08-5
4-ethynyl-1-methyl-2-nitrobenzene

Guidance literature:: With potassium carbonate; In methanol; at 4 ℃; for 36h;
DOI:10.1021/ol049915z

Reference yield: 62.0%

: 912360-87-3
2-iodo-5-pentadecylphenol

: 676260-08-5
4-ethynyl-1-methyl-2-nitrobenzene

: C₃₀H₄₁O₃N

Guidance literature:: With copper(l) iodide; diethylamine; bis-triphenylphosphine-palladium(II) chloride; In N,N-dimethyl-formamide; at 80 ℃; for 26h;
DOI:10.1055/s-2007-965939

Reference yield:

: 615-43-0
2-iodophenylamine

: 676260-08-5
4-ethynyl-1-methyl-2-nitrobenzene

: C₁₅H₁₂N₂O₂

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; In acetonitrile; at 40 ℃; Inert atmosphere;
DOI:10.1002/anie.202106518