2-Aminocyclohexanone hydrochloride - ≥97% , CAS No.6946-05-0

CAS: 6946-05-0 Cat. No.: A194627 Formule: C₆H₁₂ClNO Poids moléculaire: 149.62 Numéro CE: 809-760-5

GRADE & PURITY ≥97%

Synonyms

2-aminocyclohexan-1-one;hydrochloride | 2-aminocyclohexanonehydrochloride | HGHZKLDCXNJLJK-UHFFFAOYSA-N | Z2186882796 | DS-4614 | AMY19399 | 2-aminocyclohexan-1-one Hydrochloride | MFCD15144705 | SCHEMBL425217 | Cyclohexanone, 2-amino-, hydrochloride | EN

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonymes

2-aminocyclohexan-1-one;hydrochloride | 2-aminocyclohexanonehydrochloride | HGHZKLDCXNJLJK-UHFFFAOYSA-N | Z2186882796 | DS-4614 | AMY19399 | 2-aminocyclohexan-1-one Hydrochloride | MFCD15144705 | SCHEMBL425217 | Cyclohexanone, 2-amino-, hydrochloride | EN

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

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: C1CCC(=O)C(C1)N.Cl
• IUPAC Name: 2-aminocyclohexan-1-one;hydrochloride
• InChIKey: HGHZKLDCXNJLJK-UHFFFAOYSA-N
• INCHI: 1S/C6H11NO.ClH/c7-5-3-1-2-4-6(5)8;/h5H,1-4,7H2;1H
• Isomères SMILES: C1CCC(=O)C(C1)N.Cl
• Poids moléculaire: 149.62
• Reaxy-Rn: 3687421
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3687421&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Cyclic ketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones
• Direct Parent: Cyclic ketones
• Alternative Parents: Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclic ketone - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety.
• 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

• Poids moléculaire: 149.620 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 149.061 Da
• Monoisotopic Mass: 149.061 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 101.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Foire aux questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 6946-05-0, the molecular formula is C6H12ClNO, and the molecular weight is 149.62 g/mol. InChIKey HGHZKLDCXNJLJK-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.