1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester structure

1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester

ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate

Also Known As: Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|Ethyl 3,5-dimethyl-2-pyrrolecarboxylate|Ethyl 3,5-dimethylpyrrole-2-carboxylate|3,5-Dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester|ACMC-1CDC7|IFLab1_005847|PYR196|Jsp004468|KS-00000FMP|KS-00004CKV|1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester|2,4-dimethyl-5-carbethoxypyrrole|2-Carboethoxy-3,5-dimethylpyrrole|2,4-Dimethyl-5-carbethoxy-pyrrole|CS-D1225|Ethyl 3,5-Dimethyl-1h-Pyrrole-2- Carboxylate|3,5-dimethyl-1h-pyrrole-2-carboxylic acidethyl ester|AC-2762|ethyl 3,5dimethyl-2-pyrrolecarboxylate

CAS: 2199-44-2
Molecular Formula C9H13NO2
Molecular Weight 167.09464 g/mol
LogP 2.0
Topological Polar Surface Area 42.1 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 3
Exact Mass 167.09464
Monoisotopic Mass 167.09464
Heavy Atoms 12
Complexity 170.0

Chemical Identifiers

CAS Number 2199-44-2
SMILES CCOC(=O)C1=C(C=C(N1)C)C
InChIKey IZSBSZYFPYIJDI-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (8 patents) Catalysts (34 patents) Heterocyclic Building Blocks (82 patents) Lubricants & Additives (1 patents) Organic Building Blocks (53 patents) Organometallic Reagents (17 patents) Pharmaceutical Intermediates (101 patents) Polymer Intermediates (32 patents)

Product Overview

1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester (CAS 2199-44-2), with molecular formula C9H13NO2 and molecular weight 167.09464 g/mol. IUPAC: ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate.

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