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1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester

Base Information Edit
  • Chemical Name:1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester
  • CAS No.:87462-15-5
  • Molecular Formula:C13H13NO2
  • Molecular Weight:215.252
  • Hs Code.:
  • DSSTox Substance ID:DTXSID20465793
  • Nikkaji Number:J432.342D
  • Wikidata:Q82292022
  • Mol file:87462-15-5.mol
1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester

Synonyms:1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester;DTXSID20465793

Suppliers and Price of 1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
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Chemical Property of 1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester Edit
Chemical Property:
  • XLogP3:2.8
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Rotatable Bond Count:4
  • Exact Mass:215.094628657
  • Heavy Atom Count:16
  • Complexity:236
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1=CC=C(N1)C(=O)OCC2=CC=CC=C2
Technology Process of 1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester

There total 7 articles about 1H-Pyrrole-2-carboxylic acid, 5-methyl-, phenylmethyl ester 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:
Guidance literature:
With ethandithiol; boron trifluoride diethyl etherate; In acetic acid; Heating;
DOI:10.1021/jo00172a067
Guidance literature:
With sodium acetate; acetic acid; zinc; In water; at 78 ℃; for 2h; Yield given;
DOI:10.1021/jo00374a031
Guidance literature:
Multi-step reaction with 2 steps
1: sodium nitrite, glacial acetic acid / H2O / 1 h / 5 °C
2: zinc, sodium acetate, acetic acid / H2O / 2 h / 78 °C
With sodium acetate; acetic acid; zinc; sodium nitrite; In water;
DOI:10.1021/jo00374a031
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