N-Ethyltetrahydropyran-4-amine - ≥97% , CAS No.211814-15-2

CAS: 211814-15-2 Cat. No.: E168551 Formule: C₇H₁₅NO Poids moléculaire: 129.20 Numéro CE: 808-707-3

GRADE & PURITY ≥97%

Synonyms

Ethyl-(tetrahydro-pyran-4-yl)-amine, AldrichCPR | A815185 | FT-0695178 | STK505637 | N-Ethyl-tetrahydro-2H-pyran-4-amine hydrochloride | MRBDURJWQDYZGN-UHFFFAOYSA-N | N-ETHYL-N-TETRAHYDRO-2H-PYRAN-4-YLAMINE | DS-15089 | N-ethyloxan-4-amine | AM100504 | BC

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonymes

Ethyl-(tetrahydro-pyran-4-yl)-amine, AldrichCPR | A815185 | FT-0695178 | STK505637 | N-Ethyl-tetrahydro-2H-pyran-4-amine hydrochloride | MRBDURJWQDYZGN-UHFFFAOYSA-N | N-ETHYL-N-TETRAHYDRO-2H-PYRAN-4-YLAMINE | DS-15089 | N-ethyloxan-4-amine | AM100504 | BC

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥97%

Noms et identifiants

Sourires canoniques

CCNC1CCOCC1

IUPAC Name

N-ethyloxan-4-amine

InChIKey

MRBDURJWQDYZGN-UHFFFAOYSA-N

INCHI

1S/C7H15NO/c1-2-8-7-3-5-9-6-4-7/h7-8H,2-6H2,1H3

Isomères SMILES

CCNC1CCOCC1

Poids moléculaire

129.20

Reaxy-Rn

13742446

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13742446&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Oxanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Oxanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxanes
• Alternative Parents: Oxacyclic compounds Dialkylamines Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxane - Oxacycle - Secondary amine - Ether - Secondary aliphatic amine - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as oxanes. These are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen 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

Propriétés chimiques et physiques

• Sensibilité: light sensitive
• Poids moléculaire: 129.199 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 129.115 Da
• Monoisotopic Mass: 129.115 Da
• Topological Polar Surface Area: 21.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 69.300
• 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