4-(dimethylamino)-4-phenylcyclohexan-1-one - ≥97% , CAS No.65619-20-7

CAS: 65619-20-7 Cat. No.: D177075 Summenformel: C₁₄H₁₉NO Molekulargewicht: 217.312

GRADE & PURITY ≥97%

Synonyms

4-dimethylamino-4-phenyl cyclohexanone | 4-(dimethylamino)-4-phenylcyclohexan-1-one | A858191 | SY097997 | SB17733 | P14980 | 4-dimethylamino-4-phenylcyclohexanone | 4-Dimethylamino-4-phenyl-cyclohexanone | 4-dimethylamino-4-phenylcyclo-hexanone | DEOPEYZ

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

4-dimethylamino-4-phenyl cyclohexanone | 4-(dimethylamino)-4-phenylcyclohexan-1-one | A858191 | SY097997 | SB17733 | P14980 | 4-dimethylamino-4-phenylcyclohexanone | 4-Dimethylamino-4-phenyl-cyclohexanone | 4-dimethylamino-4-phenylcyclo-hexanone | DEOPEYZ

Spezifikationen & Reinheit

≥97%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: CN(C)C1(CCC(=O)CC1)C2=CC=CC=C2
• IUPAC Name: 4-(dimethylamino)-4-phenylcyclohexan-1-one
• InChIKey: DEOPEYZZVGZQFC-UHFFFAOYSA-N
• INCHI: 1S/C14H19NO/c1-15(2)14(10-8-13(16)9-11-14)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3
• Isomere SMILES: CN(C)C1(CCC(=O)CC1)C2=CC=CC=C2
• Molekulargewicht: 217.312
• Reaxy-Rn: 2723746
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2723746&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aralkylamines
• Alternative Parents: Benzene and substituted derivatives Trialkylamines Cyclic ketones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aralkylamine - Benzenoid - Monocyclic benzene moiety - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 217.310 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 217.147 Da
• Monoisotopic Mass: 217.147 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 243.000
• 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

Häufig gestellte Fragen

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 room temperature.

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 65619-20-7, the molecular formula is C14H19NO, and the molecular weight is 217.312 g/mol. InChIKey DEOPEYZZVGZQFC-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.