1-Piperidineacetaldehydediethylacetal - ≥99% , CAS No.3616-58-8

CAS: 3616-58-8 Cat. No.: P133318 Formula: C₁₁H₂₃NO₂ Peso molecolare: 201.31 Numero EC: 222-802-1 PubChem CID: 77165

QUALITÀ & PUREZZA ≥99%

Synonyms

Piperidine, 1-(2,2-diethoxyethyl)- (9CI) | Piperidine, 1-(2,2-diethoxyethyl)- | MFCD00006505 | DTXSID40189727 | BRN 0109383 | EINECS 222-802-1 | AS-60496 | 1-(2,2-Diethoxyethyl)piperidine | 1-(2,2-Diethoxyethyl)piperidine # | NSC 66158 | VSHHRRNJQBETGT-UH

Storage

Room temperature

Shipped In

Normal

Panoramica

Reactant for: Ethylene trimerisation;Synthesis of aryl-substituted piperidines by superacid activation of piperidones;Studies involving elimination reactions

Specifiche

Sinonimi

Piperidine, 1-(2,2-diethoxyethyl)- (9CI) | Piperidine, 1-(2,2-diethoxyethyl)- | MFCD00006505 | DTXSID40189727 | BRN 0109383 | EINECS 222-802-1 | AS-60496 | 1-(2,2-Diethoxyethyl)piperidine | 1-(2,2-Diethoxyethyl)piperidine # | NSC 66158 | VSHHRRNJQBETGT-UH

Specifiche e purezza

≥99%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

488185378

Sorrisi canonici

CCOC(CN1CCCCC1)OCC

IUPAC Name

1-(2,2-diethoxyethyl)piperidine

InChIKey

VSHHRRNJQBETGT-UHFFFAOYSA-N

INCHI

1S/C11H23NO2/c1-3-13-11(14-4-2)10-12-8-6-5-7-9-12/h11H,3-10H2,1-2H3

Isomeri SMILES

CCOC(CN1CCCCC1)OCC

WGK Germania

3

RTECS

TM3505000

PubChem CID

77165

Peso molecolare

201.31

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Piperidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Piperidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Piperidines
• Alternative Parents: Trialkylamines Azacyclic compounds Acetals Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Piperidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.443
• Punto di infiammabilità (°F): 177.8 °F
• Punto di infiammabilità (°C): 81 °C
• Punto di fusione (°C): 219-221°C
• Peso molecolare: 201.310 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 201.173 Da
• Monoisotopic Mass: 201.173 Da
• Topological Polar Surface Area: 21.700 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 129.000
• 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

Domande frequenti

How should this product be stored?

Store at room temperature.

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 3616-58-8, the molecular formula is C11H23NO2, and the molecular weight is 201.31 g/mol. InChIKey VSHHRRNJQBETGT-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.