Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CCOC1=C(N=C(C=C1)C)C(=O)N2C[C@@H]3C[C@@H]3C[C@H]2CNC4=NC=C(C=N4)C(F)(F)F |
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| IUPAC Name | (3-ethoxy-6-methylpyridin-2-yl)-[(1R,4S,6R)-4-[[[5-(trifluoromethyl)pyrimidin-2-yl]amino]methyl]-3-azabicyclo[4.1.0]heptan-3-yl]methanone |
| InChIKey | MJEJGMUTGRYQJO-YCPHGPKFSA-N |
| INCHI | 1S/C21H24F3N5O2/c1-3-31-17-5-4-12(2)28-18(17)19(30)29-11-14-6-13(14)7-16(29)10-27-20-25-8-15(9-26-20)21(22,23)24/h4-5,8-9,13-14,16H,3,6-7,10-11H2,1-2H3,(H,25,26,27)/t13-,14+,16+/m1/s1 |
| Isomeric SMILES | CCOC1=C(N=C(C=C1)C)C(=O)N2C[C@@H]3C[C@@H]3C[C@H]2CNC4=NC=C(C=N4)C(F)(F)F |
| PubChem CID | 46218798 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Pyridines and derivatives |
| Subclass | Pyridinecarboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyridinecarboxylic acids and derivatives |
| Alternative Parents | N-acylpiperidines 2-heteroaryl carboxamides Secondary alkylarylamines Alkyl aryl ethers Methylpyridines Azepanes Aminopyrimidines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | N-acyl-piperidine - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Alkyl aryl ether - Aminopyrimidine - Azepane - Methylpyridine - Secondary aliphatic/aromatic amine - Piperidine - Pyrimidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Carboxamide group - Secondary amine - Azacycle - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Amine - Alkyl halide - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof. |
| External Descriptors | Not available |
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