1-Methyl-4-nitro-1H-pyrrole-2-carbaldehyde

Base Information

Chemical Name:1-Methyl-4-nitro-1H-pyrrole-2-carbaldehyde
CAS No.:18711-27-8
Molecular Formula:C6H6N2O3
Molecular Weight:154.12300
Hs Code.:2933990090
DSSTox Substance ID:DTXSID40492708
Nikkaji Number:J1.367.248B
Wikidata:Q82338836
Mol file:18711-27-8.mol

Synonyms:1-METHYL-4-NITRO-1H-PYRROLE-2-CARBALDEHYDE;18711-27-8;1-METHYL-4-NITROPYRROLE-2-CARBALDEHYDE;1-methyl-4-nitro-2-pyrrolecarboxaldehyde;SCHEMBL2400189;DTXSID40492708;XGKIWLRDLSNCRB-UHFFFAOYSA-N;AKOS006230344;AB50299;N-methyl-4-nitro-pyrrol-2-carboxaldehyde

Suppliers and Price of 1-Methyl-4-nitro-1H-pyrrole-2-carbaldehyde

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-methyl-4-nitro-1H-Pyrrole-2-carboxaldehyde 97.00%
1G
$ 1740.00

AccelPharmtech
1-methyl-4-nitro-1H-Pyrrole-2-carboxaldehyde 97.00%
5G
$ 2960.00

AccelPharmtech
1-methyl-4-nitro-1H-Pyrrole-2-carboxaldehyde 97.00%
25G
$ 5520.00

American Custom Chemicals Corporation
1-METHYL-4-NITRO-1H-PYRROLE-2-CARBALDEHYDE 95.00%
5MG
$ 502.48

Total 2 raw suppliers

Chemical Property of 1-Methyl-4-nitro-1H-pyrrole-2-carbaldehyde

Chemical Property:

PSA：67.82000
LogP:1.26900
XLogP3:0.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:154.03784206
Heavy Atom Count:11
Complexity:177

Purity/Quality:

99% ^*data from raw suppliers

1-methyl-4-nitro-1H-Pyrrole-2-carboxaldehyde 97.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=C(C=C1C=O)[N+](=O)[O-]

Technology Process of 1-Methyl-4-nitro-1H-pyrrole-2-carbaldehyde

There total 2 articles about 1-Methyl-4-nitro-1H-pyrrole-2-carbaldehyde 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: 70.0%

: 1192-58-1
N-methylpyrrole aldehyde

: 18711-27-8
1-methyl-4-nitro-1H-pyrrole-2-carboxaldehyde

Guidance literature:: With nitric acid; In water; at -70 - -20 ℃; for 1h;

Reference yield: 14.0%

: 18711-27-8
1-methyl-4-nitro-1H-pyrrole-2-carboxaldehyde

Guidance literature:

Reference yield:

: 18711-27-8
1-methyl-4-nitro-1H-pyrrole-2-carboxaldehyde

: 3-(4-{[4-(3-{2-[5-(2-ethoxycarbonyl-vinyl)-1-methyl-1H-pyrrol-3-ylcarbamoyl]-1-methyl-1H-imidazol-4-ylcarbamoyl}-benzoylamino)-1-methyl-1H-imidazole-2-carbonyl]-amino}-1-methyl-1H-pyrrol-2-yl)-acrylic acid ethyl ester

Guidance literature:: Multi-step reaction with 5 steps

1.1: NaH / tetrahydrofuran / 0 °C

1.2: 1.69 g / tetrahydrofuran / 2 h / 20 °C

2.1: NaBH₄; Pd/C / methanol; H₂O / 0.33 h / 20 °C

3.1: 400 mg / i-Pr₂NEt / CH₂Cl₂ / 1 h / 20 °C

4.1: NaBH₄; Pd/C / methanol; H₂O / 0.33 h / 20 °C

5.1: i-Pr₂NEt / CH₂Cl₂ / 20 °C

With sodium tetrahydroborate; palladium on activated charcoal; sodium hydride; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; methanol; dichloromethane; water;
DOI:10.1021/ja028459b