Diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate structure

Diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate

diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate

Also Known As: Diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate|3-methyl-1H-pyrrole-2,5-dicarboxylic acid diethyl ester|3-Methyl-pyrrole-2,5-dicarboxylic acid diethyl ester|diethyl 3-methylpyrrole-2,5-dicarboxylate|diethyl 3-methyl-pyrrole-2,5-dicarboxylate|Diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate #|I14-0637|1H-Pyrrole-2,5-dicarboxylic acid, 3-methyl-, diethyl ester|2,5-DIETHYL 3-METHYL-1H-PYRROLE-2,5-DICARBOXYLATE

CAS: 29170-87-4
Molecular Formula C11H15NO4
Molecular Weight 225.10011 g/mol
LogP 2.2
Topological Polar Surface Area 68.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 6
Exact Mass 225.10011
Monoisotopic Mass 225.10011
Heavy Atoms 16
Complexity 267.0

Chemical Identifiers

CAS Number 29170-87-4
SMILES CCOC(=O)C1=CC(=C(N1)C(=O)OCC)C
InChIKey HIHHBIPXHZOHJJ-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (8 patents) Pharmaceutical Intermediates (4 patents)

Product Overview

Diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate (CAS 29170-87-4), with molecular formula C11H15NO4 and molecular weight 225.10011 g/mol. IUPAC: diethyl 3-methyl-1H-pyrrole-2,5-dicarboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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