3-(1-methylpyrrol-2-yl)prop-2-enoic Acid

Base Information

Chemical Name:3-(1-methylpyrrol-2-yl)prop-2-enoic Acid
CAS No.:51485-76-8
Molecular Formula:C8H9NO2
Molecular Weight:151.16
Hs Code.:2933990090
ChEMBL ID:CHEMBL4777728
DSSTox Substance ID:DTXSID30407063
Mol file:51485-76-8.mol

Synonyms:3-(1-methylpyrrol-2-yl)prop-2-enoic Acid;CHEMBL4777728;DTXSID30407063;BDBM50565803;SB63193

Suppliers and Price of 3-(1-methylpyrrol-2-yl)prop-2-enoic 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
Packaging
price

TRC
(2E)-3-(1-methyl-1H-pyrrol-2-yl)prop-2-enoicacid
100mg
$ 220.00

Labseeker
(2E)-3-(1-methyl-1H-pyrrol-2-yl)acrylicacid 95
5g
$ 1228.00

Labseeker
(2E)-3-(1-methyl-1H-pyrrol-2-yl)acrylicacid 95
10g
$ 2163.00

American Custom Chemicals Corporation
3-(1-METHYL-1H-PYRROL-2-YL)ACRYLIC ACID 95.00%
5G
$ 1928.08

American Custom Chemicals Corporation
3-(1-METHYL-1H-PYRROL-2-YL)ACRYLIC ACID 95.00%
2.5G
$ 1473.14

American Custom Chemicals Corporation
3-(1-METHYL-1H-PYRROL-2-YL)ACRYLIC ACID 95.00%
1G
$ 983.52

Total 7 raw suppliers

Chemical Property of 3-(1-methylpyrrol-2-yl)prop-2-enoic Acid

Chemical Property:

PSA：42.23000
LogP:1.12290
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:151.063328530
Heavy Atom Count:11
Complexity:177

Purity/Quality:

99%, ^*data from raw suppliers

(2E)-3-(1-methyl-1H-pyrrol-2-yl)prop-2-enoicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=CC=C1C=CC(=O)O

Technology Process of 3-(1-methylpyrrol-2-yl)prop-2-enoic Acid

There total 3 articles about 3-(1-methylpyrrol-2-yl)prop-2-enoic 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: 62.0%

: 1192-58-1
N-methylpyrrole aldehyde

: 141-82-2
malonic acid

: 51485-76-8
β-(1-Methyl-2-pyrryl)acrylsaeure

Guidance literature:: piperidine; In pyridine; 1.) 100 deg C, 12 h, 2.) reflux;
DOI:10.1021/jm00126a002

Reference yield:

: 96-54-8
N-Methylpyrrole

: 51485-76-8
β-(1-Methyl-2-pyrryl)acrylsaeure

Guidance literature:: Multi-step reaction with 2 steps

1: POCl₃ / 1,2-dichloro-ethane / -5 °C

2: 62 percent / piperidine / pyridine / 1.) 100 deg C, 12 h, 2.) reflux

With trichlorophosphate; piperidine; In pyridine; 1,2-dichloro-ethane;
DOI:10.1021/jm00126a002