≥90% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal 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 | COC(=O)CNC(=O)C1CCN(CC1)C(=O)OCC2=CC=CC=C2 |
|---|---|
| IUPAC Name | benzyl 4-[(2-methoxy-2-oxoethyl)carbamoyl]piperidine-1-carboxylate |
| InChIKey | FLNDYLYDKCJERI-UHFFFAOYSA-N |
| INCHI | 1S/C17H22N2O5/c1-23-15(20)11-18-16(21)14-7-9-19(10-8-14)17(22)24-12-13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3,(H,18,21) |
| Isomeric SMILES | COC(=O)CNC(=O)C1CCN(CC1)C(=O)OCC2=CC=CC=C2 |
| PubChem CID | 3776046 |
| Molecular Weight | 334.37 |
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 | Organic acids and derivatives |
| Class | Peptidomimetics |
| Subclass | Hybrid peptides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Hybrid peptides |
| Alternative Parents | Alpha amino acid esters N-acyl-alpha amino acids and derivatives Benzyloxycarbonyls Piperidinecarboxylic acids Piperidinecarboxamides Methyl esters Carbamate esters Secondary carboxylic acid amides Organic carbonic acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Hybrid peptide - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Piperidinecarboxylic acid - Piperidinecarboxamide - Monocyclic benzene moiety - Benzenoid - Piperidine - Methyl ester - Carbamic acid ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as hybrid peptides. These are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond. |
| External Descriptors | Not available |
| Molecular Weight | 334.400 g/mol |
|---|---|
| XLogP3 | 1.300 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 334.153 Da |
| Monoisotopic Mass | 334.153 Da |
| Topological Polar Surface Area | 84.900 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 440.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
![Benzyl 4-[(2-methoxy-2-oxoethyl)carbamoyl]piperidine-1-carboxylate - ≥90% , CAS No.477870-13-6](https://www.aladdinsci.com/media/catalog/product/placeholder/default/default_4.jpg)