3-Decanone - ≥98%(GC) , CAS No.928-80-3

CAS: 928-80-3 Cat. No.: D154228 Formule: C₁₀H₂₀O Poids moléculaire: 156.27 Beilstein Registry Number: 1(4)3368 Numéro CE: 213-183-9

QUALITÉ & PURETÉ ≥98%(GC)

Synonyms

3-DECANONE [FHFI] | 3-DECANONE | Ethyl n-heptyl ketone | D1162 | decan-3-one | FT-0615582 | Q27159516 | UNII-CBT4991PRJ | FEMA NO. 3966 | 3-Decanone, >=97% | 3-Decanone, 98% | CBT4991PRJ | SCHEMBL8643109 | 3-Decanone, >=97%, FG | SCHEMBL105548 | LMFA12000

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

3-DECANONE [FHFI] | 3-DECANONE | Ethyl n-heptyl ketone | D1162 | decan-3-one | FT-0615582 | Q27159516 | UNII-CBT4991PRJ | FEMA NO. 3966 | 3-Decanone, >=97% | 3-Decanone, 98% | CBT4991PRJ | SCHEMBL8643109 | 3-Decanone, >=97%, FG | SCHEMBL105548 | LMFA12000

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

488181868

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181868

Sourires canoniques

CCCCCCCC(=O)CC

IUPAC Name

decan-3-one

InChIKey

XJLDYKIEURAVBW-UHFFFAOYSA-N

INCHI

1S/C10H20O/c1-3-5-6-7-8-9-10(11)4-2/h3-9H2,1-2H3

Isomères SMILES

CCCCCCCC(=O)CC

Poids moléculaire

156.27

Beilstein

1(4)3368

Reaxy-Rn

1748021

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1748021&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Ketones
• Alternative Parents: Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol.
• External Descriptors: Oxygenated hydrocarbons

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

Mécanismes d'action

Propriétés chimiques et physiques

• Indice de réfraction: 1.43
• Point d'éclair (°F): 62°C(lit.)
• Point d'éclair (°C): 62°C
• Point d'ébullition (°C): 211°C(lit.)
• Point de fusion (°C): -4~-3 °C
• Poids moléculaire: 156.260 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 156.151 Da
• Monoisotopic Mass: 156.151 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 97.000
• 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

Foire aux questions

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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

The CAS Number is 928-80-3, the molecular formula is C10H20O, and the molecular weight is 156.27 g/mol. InChIKey XJLDYKIEURAVBW-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.