≥95% 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.
| Sonrisas canónicas | CCOC(=O)CCCCC(=O)C1=CC=CC(=C1)CN2CCC3(CC2)OCCO3 |
|---|---|
| IUPAC Name | ethyl 6-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)phenyl]-6-oxohexanoate |
| InChIKey | GYVCNVDGTHUSPG-UHFFFAOYSA-N |
| INCHI | 1S/C22H31NO5/c1-2-26-21(25)9-4-3-8-20(24)19-7-5-6-18(16-19)17-23-12-10-22(11-13-23)27-14-15-28-22/h5-7,16H,2-4,8-15,17H2,1H3 |
| Isómeros SMILES | CCOC(=O)CCCCC(=O)C1=CC=CC(=C1)CN2CCC3(CC2)OCCO3 |
| PubChem CID | 24724950 |
| Peso molecular | 389.492 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Piperidines |
| Subclass | Benzylpiperidines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | N-benzylpiperidines |
| Alternative Parents | Alkyl-phenylketones Butyrophenones Azaspirodecane derivatives Aryl alkyl ketones Phenylmethylamines Benzoyl derivatives Benzylamines Fatty acid esters Aralkylamines Ketals 1,3-dioxolanes Carboxylic acid esters Amino acids and derivatives Trialkylamines Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Aldehydes Organic oxides Organopnictogen compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | N-benzylpiperidine - Alkyl-phenylketone - Butyrophenone - Azaspirodecane - Phenylketone - Phenylmethylamine - Benzoyl - Benzylamine - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Ketal - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Meta-dioxolane - Tertiary amine - Ketone - Carboxylic acid ester - Tertiary aliphatic amine - Amino acid or derivatives - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom. |
| External Descriptors | Not available |
| Peso molecular | 389.500 g/mol |
|---|---|
| XLogP3 | 2.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 10 |
| Exact Mass | 389.22 Da |
| Monoisotopic Mass | 389.22 Da |
| Topological Polar Surface Area | 65.099 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 507.000 |
| 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 |
![Ethyl 6-[3-[1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl]phenyl]-6-oxohexanoate - ≥95% , CAS No.898762-64-6](https://www.aladdinsci.com/media/catalog/product/placeholder/default/default_4.jpg)