1H-Pyrazole-4-carboxylic acid, 5-cyano-1-(3-methylphenyl)-, ethyl ester
ethyl 5-cyano-1-(3-methylphenyl)pyrazole-4-carboxylate
Also Known As: Ethyl 5-cyano-1-(3-methylphenyl)-1H-pyrazole-4-carboxylate|1H-Pyrazole-4-carboxylic acid, 5-cyano-1-(3-methylphenyl)-, ethyl ester|Ethyl 5-cyano-1-(m-tolyl)-1H-pyrazole-4-carboxylate|ethyl 5-cyano-1-(3-methylphenyl)-4-pyrazolecarboxylate|ethyl 5-cyano-1-(3-methylphenyl)pyrazole-4-carboxylate|5-cyano-1-(m-tolyl)-1H-pyrazole-4-carboxylic acid ethyl ester
| Molecular Formula | C14H13N3O2 |
|---|---|
| Molecular Weight | 255.10077 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.10077 |
| Monoisotopic Mass | 255.10077 |
| Heavy Atoms | 19 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 98476-13-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1)C2=CC=CC(=C2)C)C#N |
| InChIKey | ABGIIDLTTLKRLV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrazole-4-carboxylic acid, 5-cyano-1-(3-methylphenyl)-, ethyl ester (CAS 98476-13-2), with molecular formula C14H13N3O2 and molecular weight 255.10077 g/mol. IUPAC: ethyl 5-cyano-1-(3-methylphenyl)pyrazole-4-carboxylate.
1H-Pyrazole-4-carboxylic acid, 5-cyano-1-(3-methylphenyl)-, ethyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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