| Weight | 195.262 g/mol |
|---|---|
| Formula | C11H17NO2 |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 3 |
ethyl 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate (2199-47-5)
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- A combined experimental and quantum chemical (DFT and AIM) study on molecular structure, spectroscopic properties, NBO and multiple interaction analysis in a novel ethyl 4-[2-(carbamoyl)hydrazinylidene]-3,5-dimethyl-1H-pyrrole-2-carboxylate and its dimer (Journal of Molecular Structure, 2013)
- Molecular structure, heteronuclear resonance assisted hydrogen bond analysis, chemical reactivity and first hyperpolarizability of a novel ethyl-4-{((2,4- dinitrophenyl)-hydrazono)-ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate: A combined DFT and AIM approach (Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2012)
- Molecular structure, spectral studies, intra and intermolecular interactions analyses in a novel ethyl 4-(3-(2-chloro-phenyl)-acryloyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate and its dimer: A combined DFT and AIM approach (Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2012)
- Spectral analysis, structural elucidation, and evaluation of both nonlinear optical properties and chemical reactivity of a newly synthesized ethyl-3,5-dimethyl-4-[(toluenesulfonyl)-hydrazonomethyl]-1H-pyrrole-2-carboxylate through experimental studies and quantum chemical calculations (Journal of Molecular Structure, 2013)
- Spectral analysis, structural elucidation and evaluation of chemical reactivity of synthesized ethyl-4-[(2-cyano-acetyl)-hydrazonomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate through experimental studies and quantum chemical calculations (Journal of Molecular Structure, 2014)
- A combined experimental and theoretical (DFT and AIM) studies on synthesis, molecular structure, spectroscopic properties and multiple interactions analysis in a novel Ethyl-4-[2-(thiocarbamoyl)hydrazinylidene]-3,5-dimethyl-1H-pyrrole-2-carboxylate and its dimer (Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2013)
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SMILESCCC1=C(NC(=C1C)C(=O)OCC)C
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InChIKeyGIGBRYTXWUHNAZ-UHFFFAOYSA-N
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Synthesis
Reactant
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Chloroethane
(Ester from carboxilic acid(SN2))
Similar Compounds
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diethyl 3-methyl-1h-pyrrole-2,4-dicarboxylate
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4,5,6,7-Tetrahydro-1H-indole-2-carboxylic acid
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3-Methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid
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ethyl 4-formyl-1H-pyrrole-2-carboxylate
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3,6,6-Trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid
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2199-59-9
(2199-59-9)
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6314-22-3
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methyl 4-methyl-1H-pyrrole-2-carboxylate
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ethyl 5-formyl-1H-pyrrole-2-carboxylate
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Ethyl 5-methyl-1H-pyrrole-2-carboxylate
(3284-51-3)
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methyl 4-formyl-1H-pyrrole-2-carboxylate
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diethyl pyridine-2,5-dicarboxylate
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diethyl pyridine-2,6-dicarboxylate
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ethyl 3-formyl-5-methoxy-1H-indole-2-carboxylate
(36820-78-7)
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methyl 3-formyl-1H-indole-2-carboxylate
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dimethyl pyridine-2,5-dicarboxylate
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methyl 5-fluoro-3-formyl-1H-indole-2-carboxylate
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dimethyl pyridine-2,4-dicarboxylate
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ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate
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ETHYL PICOLINATE
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ethyl 2,4-dimethylnicotinate
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3-Methylpicolinic acid
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17874-79-2
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Hexyl picolinate
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Octyl picolinate
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Ethyl 5-hydroxyindole-2-carboxylate
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37033-95-7
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6,7-Dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
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23466-27-5
(23466-27-5)
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Ethyl 1-methylpyrrole-2-carboxylate
(23466-27-5)
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3-Acetyl-2,4-dimethylpyrrole
(2386-25-6)
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3-Methyl-1H-indole-2-carboxylic acid
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Ethyl 6-methoxy-1H-indole-2-carboxylate
(15050-04-1)
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1H-Pyrrole-2-carboxylic acid, 5-ethyl-
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3,5-Dimethyl-1H-indole-2-carboxylic acid
(16381-45-6)
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4792-58-9
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4,6-Dimethylpicolinic acid
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27737-55-9
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ethyl 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
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