Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate

Base Information

Chemical Name:Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate
CAS No.:175137-01-6
Molecular Formula:C11H13 N3 O2
Molecular Weight:219.243
Hs Code.:2933990090
DSSTox Substance ID:DTXSID00380531
Nikkaji Number:J3.510.033D
Wikidata:Q82170797
Mol file:175137-01-6.mol

Synonyms:175137-01-6;Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate;ethyl 1-methyl-5-pyrrol-1-ylpyrazole-4-carboxylate;1H-Pyrazole-4-carboxylicacid, 1-methyl-5-(1H-pyrrol-1-yl)-, ethyl ester;Maybridge1_003715;SCHEMBL1407142;HMS552A19;DTXSID00380531;MYLCLHCKBABUTD-UHFFFAOYSA-N;CCG-50244;MFCD00052539;AKOS015908684;PS-4341;SB62074;CS-0333857;FT-0625838;J3.510.033D;SR-01000639637-1;Ethyl1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate;1-methyl-5-pyrrol-1-yl-1H-pyrazole-4-carboxylic acid ethyl ester;1-Methyl-5-(1H-pyrrole-1-yl)-1H-pyrazole-4-carboxylic acid ethyl ester;1H-Pyrazole-4-carboxylicacid,1-methyl-5-(1H-pyrrol-1-yl)-,ethyl ester

Suppliers and Price of Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate

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

TRC
Ethyl1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate
2.5mg
$ 45.00

SynQuest Laboratories
Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate
250 mg
$ 56.00

American Custom Chemicals Corporation
ETHYL 1-METHYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLATE 95.00%
1G
$ 781.24

American Custom Chemicals Corporation
ETHYL 1-METHYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLATE 95.00%
250MG
$ 635.71

Total 8 raw suppliers

Chemical Property of Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate

Chemical Property:

Vapor Pressure:9.21E-06mmHg at 25°C
Boiling Point:373°Cat760mmHg
PKA:-1.59±0.10(Predicted)
Flash Point:179.4°C
PSA：49.05000
Density:1.21g/cm³
LogP:1.38750
XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:219.100776666
Heavy Atom Count:16
Complexity:254

Purity/Quality:

98% ^*data from raw suppliers

Ethyl1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=C(N(N=C1)C)N2C=CC=C2

Technology Process of Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate

There total 2 articles about Ethyl 1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylate 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: 85.0%

: 696-59-3
cis,trans-2,5-dimethoxytetrahydrofuran

: 31037-02-2
ethyl 5-amino-1-methyl-1H-pyrazole-4-carboxylate

: 175137-01-6
ethyl 1-methyl-5-pyrrol-1-yl-1H-pyrazole-4-carboxylate

Guidance literature:: With acetic acid; for 3h; Heating;
DOI:10.1002/jhet.5570380506

Reference yield:

: 42466-67-1,42466-69-3
ethyl (ethoxymethylene)cyanoacetate

: 175137-01-6
ethyl 1-methyl-5-pyrrol-1-yl-1H-pyrazole-4-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 86 percent / ethanol / 12 h / Heating

2: 85 percent / AcOH / 3 h / Heating

With acetic acid; In ethanol; 2: Clauson-Kass reaction;
DOI:10.1002/jhet.5570380506