Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate

Base Information

• Chemical Name: Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate
• CAS No.: 71959-95-0
• Molecular Formula: C10H13 N O4
• Molecular Weight: 211.21452
• European Community (EC) Number: 276-208-2
• DSSTox Substance ID: DTXSID20222242
• Nikkaji Number: J318.815I
• Wikidata: Q83100431
• Mol file: 71959-95-0.mol

Synonyms:71959-95-0;Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate;2-(2-methoxy-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylic acid;1H-Pyrrole-2-aceticacid, 3-carboxy-1,4-dimethyl-, 2-methyl ester;2-(2-methoxy-2-oxoethyl)-1,4-dimethylpyrrole-3-carboxylic acid;EINECS 276-208-2;DTXSID20222242;AKOS022650384;NS00037307;EN300-248354;Z1617999518;2-(2-methoxy-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylicacid

Chemical Property of Methyl 3-carboxy-1,4-dimethyl-1H-pyrrole-2-acetate

Chemical Property:

• Vapor Pressure: 1.9E-05mmHg at 25°C
• Boiling Point: 348.4°C at 760 mmHg
• Flash Point: 164.5°C
• PSA: 68.53000
• Density: 1.23g/cm³
• LogP: 0.74720
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 211.08445790
• Heavy Atom Count: 15
• Complexity: 266

Purity/Quality:

99% ^*data from raw suppliers

2-(2-methoxy-2-oxoethyl)-1,4-dimethyl-1H-pyrrole-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CN(C(=C1C(=O)O)CC(=O)OC)C