2-Pentadecanone - ≥95%(GC) , CAS No.2345-28-0

CAS: 2345-28-0 Cat. No.: P160486 分子式: C₁₅H₃₀O 分子量: 226.4 EC番号: 219-064-8 PubChem CID: 61303

GRADE & PURITY ≥95%(GC)

Synonyms

D92066 | B2Q48J997N | CAA34528 | DTXSID6062333 | A878236 | Pentadecanone | AKOS009157795 | J-015112 | AI3-11706 | 2-Pentandecanone | Methyl tridecyl ketone | FT-0613261 | AS-56748 | 2-PENTADECANONE | Pentadecan-2-one | 2-Pentadecanone, >=98.5% | EINECS 21

Storage

Room temperature

Shipped In

Normal

概要

application：

It is primarily used as a flavoring substances to impart a fatty, slightly spicy, and floral flavor. 2-Pentadecanone can perfectly compliment and enhance a variety of foods including butters, cheeses and meats.

Specifications

同義語

D92066 | B2Q48J997N | CAA34528 | DTXSID6062333 | A878236 | Pentadecanone | AKOS009157795 | J-015112 | AI3-11706 | 2-Pentandecanone | Methyl tridecyl ketone | FT-0613261 | AS-56748 | 2-PENTADECANONE | Pentadecan-2-one | 2-Pentadecanone, >=98.5% | EINECS 21

仕様と純度

≥95%(GC)

保管条件

Room temperature

入荷

Normal

アクションタイプ

INHIBITOR

純度

≥95%(GC)

名前と識別子

• パブケム・シド: 488183479
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/488183479
• カノニカル・スマイル: CCCCCCCCCCCCCC(=O)C
• IUPAC Name: pentadecan-2-one
• InChIKey: CJPNOLIZCWDHJK-UHFFFAOYSA-N
• INCHI: 1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(2)16/h3-14H2,1-2H3
• 異性体SMILES: CCCCCCCCCCCCCC(=O)C
• WGKドイツ: 3
• PubChem CID: 61303
• 分子量: 226.4
• Reaxy-Rn: 1764872

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 分類: 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
• 説明: 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: a ketone

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

関連ターゲット（非人間）

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in toluene (almost transparency). Insoluble in water.
• 引火点（°F）: 235.4 °F
• 引火点（°C）: 113 °C
• 沸点（°C）: 293℃
• 融点（°C）: 39℃
• 分子量: 226.400 g/mol
• XLogP3: 6.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 12
• Exact Mass: 226.23 Da
• Monoisotopic Mass: 226.23 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 152.000
• 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

参考文献

1. Chengrui Liang, Shuxiao Wang, Bin Zhao, Boyang Feng, Qipeng Qu, Liang Zhu, Jiming Hao.  (2025)  Impact of Molecular Structure on Secondary Organic Aerosol Formation from Aliphatic Carbonyls.  ENVIRONMENTAL SCIENCE & TECHNOLOGY,      [PMID:40552609] [10.1021/acs.est.5c00793]

2. Qingfu Wang, Jiaming Zhao, Zening Wang, Liuke Zhang, Lei Li, Yibo Ning, Zhipeng Jing, Pengfei Yang, Yongzhen Zhao, Changtong Lu.  (2026)  Study on the enhancement of volatile components extraction from Lysimachia foenum-graecum Hance essential oil by metal salts.  Frontiers in Chemistry,      [PMID:42482699] [10.3389/fchem.2026.1869613]

よくある質問

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

This product is supplied at ≥95% 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.

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 2345-28-0, the molecular formula is C15H30O, and the molecular weight is 226.4 g/mol. InChIKey CJPNOLIZCWDHJK-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.