4-methoxy-1,4'-bipiperidine - ≥97% , CAS No.930603-98-8

CAS: 930603-98-8 Cat. No.: M178273 Summenformel: C₁₁H₂₂N₂O Molekulargewicht: 198.31

GRADE & PURITY ≥97%

Synonyms

QYTOCUJJGMOUDF-UHFFFAOYSA-N | SB13151 | 4-methoxy-1-(piperidin-4-yl)piperidine | 1-(4-PIPERIDINYL)-4-METHOXY-PIPERIDINE | 4-methoxy-1-piperidin-4-ylpiperidine | AMY34978 | AS-53114 | SCHEMBL233141 | AKOS009464987 | 4-Methoxy-1,4 inverted exclamation mark

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

QYTOCUJJGMOUDF-UHFFFAOYSA-N | SB13151 | 4-methoxy-1-(piperidin-4-yl)piperidine | 1-(4-PIPERIDINYL)-4-METHOXY-PIPERIDINE | 4-methoxy-1-piperidin-4-ylpiperidine | AMY34978 | AS-53114 | SCHEMBL233141 | AKOS009464987 | 4-Methoxy-1,4 inverted exclamation mark

Spezifikationen & Reinheit

≥97%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: COC1CCN(CC1)C2CCNCC2
• IUPAC Name: 4-methoxy-1-piperidin-4-ylpiperidine
• InChIKey: QYTOCUJJGMOUDF-UHFFFAOYSA-N
• INCHI: 1S/C11H22N2O/c1-14-11-4-8-13(9-5-11)10-2-6-12-7-3-10/h10-12H,2-9H2,1H3
• Isomere SMILES: COC1CCN(CC1)C2CCNCC2
• Molekulargewicht: 198.31
• Reaxy-Rn: 15465791
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15465791&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Piperidines
      • Subclass Aminopiperidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Piperidines
• Subclass: Aminopiperidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminopiperidines
• Alternative Parents: Trialkylamines Dialkylamines Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 4-aminopiperidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Secondary amine - Ether - Secondary aliphatic amine - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aminopiperidines. These are compounds containing a piperidine that carries an amino group.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 198.310 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 198.173 Da
• Monoisotopic Mass: 198.173 Da
• Topological Polar Surface Area: 24.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 161.000
• 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