cis-2，6-Dimethylmorphine - ≥97%(GC) , CAS No.6485-55-8

CAS: 6485-55-8 Cat. No.: C133540 Formule: C₆H₁₃NO Poids moléculaire: 115.18 Numéro CE: 229-353-0

GRADE & PURITY ≥97%(GC)

Synonyms

2098200-15-6 | cis-2,6-dimethymorpholine | 2,6-cis-dimethylmorpholin | cis-2,6-Dimethylmorphine | Q27292052 | 2773424-97-6 | AS-10974 | cis-2,6-dimethyl morpholine | cis-2,6-dimethylmorpholin | EN300-107440 | InChI=1/C6H13NO/c1-5-3-7-4-6(2)8-5/h5-7H,3-4H2

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonymes

2098200-15-6 | cis-2,6-dimethymorpholine | 2,6-cis-dimethylmorpholin | cis-2,6-Dimethylmorphine | Q27292052 | 2773424-97-6 | AS-10974 | cis-2,6-dimethyl morpholine | cis-2,6-dimethylmorpholin | EN300-107440 | InChI=1/C6H13NO/c1-5-3-7-4-6(2)8-5/h5-7H,3-4H2

Spécifications et pureté

≥97%(GC)

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥97%(GC)

Noms et identifiants

• Pubchem Sid: 488190925
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488190925
• Sourires canoniques: CC1CNCC(O1)C
• IUPAC Name: (2S,6R)-2,6-dimethylmorpholine
• InChIKey: HNVIQLPOGUDBSU-OLQVQODUSA-N
• INCHI: 1S/C6H13NO/c1-5-3-7-4-6(2)8-5/h5-7H,3-4H2,1-2H3/t5-,6+
• Isomères SMILES: C[C@@H]1CNC[C@@H](O1)C
• Groupe d'emballage: III
• Poids moléculaire: 115.18
• Reaxy-Rn: 103036
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=103036&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Oxazinanes
      • Subclass Morpholines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Morpholines
• Alternative Parents: Oxacyclic compounds Dialkylamines Dialkyl ethers Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Morpholine - Oxacycle - Azacycle - Secondary amine - Ether - Secondary aliphatic amine - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as morpholines. These are organic compounds containing a morpholine moiety, which consists of a six-member aliphatic saturated ring with the formula C4H9NO, where the oxygen and nitrogen atoms lie at positions 1 and 4, respectively.
• 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: Air Sensitive
• Indice de réfraction: 1.45
• Point d'éclair (°F): 109.4℉
• Point d'éclair (°C): 43°C(lit.)
• Point d'ébullition (°C): 147 °C
• Poids moléculaire: 115.170 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 115.1 Da
• Monoisotopic Mass: 115.1 Da
• Topological Polar Surface Area: 21.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 66.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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