2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic acid

Base Information

Chemical Name:2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic acid
CAS No.:5729-30-6
Molecular Formula:C₁₀H₇NO₂S₂
Molecular Weight:237.303
Hs Code.:
DSSTox Substance ID:DTXSID80417071
Wikidata:Q82226731

Synonyms:5729-30-6;AC1NSZZD;DTXSID80417071;STK804825;AKOS000600605;2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic acid;BIM-0029216.P001;SR-01000472512;SR-01000472512-1;methyl (4Z)-2-methyl-4-(3-nitrobenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Suppliers and Price of 2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic 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
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price

Total 1 raw suppliers

Chemical Property of 2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic acid

Chemical Property:

Vapor Pressure:3.54E-11mmHg at 25°C
Boiling Point:526.5°C at 760 mmHg
Flash Point:272.2°C
Density:1.387g/cm³
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:288.07462149
Heavy Atom Count:21
Complexity:544

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)N1)C(=O)OC
Isomeric SMILES:CC1=C(/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)N1)C(=O)OC

Technology Process of 2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic acid

There total 1 articles about 2-Methyl-4-(3-nitro-benzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic 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:

: 79-37-8
oxalyl dichloride

: 54895-19-1
benzyl dithiocarbamate

: 5729-30-6
2-benzylsulfanyl-thiazole-4,5-dione

Guidance literature:: In tetrahydrofuran; diethyl ether;

Reference yield:

: 5729-30-6
2-benzylsulfanyl-thiazole-4,5-dione

: 5729-40-8
N--N'-phenyl-harnstoff

Guidance literature:: Multi-step reaction with 2 steps

1: toluene / 0.33 h / 80 °C

2: H₂O / acetone / Heating

With water; In acetone; toluene;