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2-Decanone - analytical standard,≥99.5% (GC), high purity , CAS No.693-54-9

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2-Decanone - analytical standard,≥99.5% (GC), high purity , CAS No.693-54-9

3 Citations

COA

Grade & Purity:

analytical standard

≥99.5%(GC)

Cas Number: 693-54-9
Molecular Weight: 156.27
Beilstein Registry Number: 1747463
EC Number: 211-752-6
MDL number: MFCD00009571
PubChem CID: 12741

In stock

Item Number

D139186

Grouped product items
SKU	Size	Availability	Price	Qty
D139186-5ml	5ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$23.90
D139186-25ml	25ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$104.90

View related series

ketone (798) Non heterocyclic block (8163)

Basic Description

Synonyms	CHEBI:77929 \| 2-Decanone, 98% \| GX543OLT0R \| A836446 \| Octyl methyl ketone \| CAS-693-54-9 \| AKOS009158912 \| EN300-170618 \| Q20054515 \| FT-0612135 \| n-C8H17COCH3 \| BRN 1747463 \| 2-Decanone, >=98% \| SCHEMBL103053 \| EINECS 211-752-6 \| 2-Decanone, analytical
Specifications & Purity	analytical standard, ≥99.5%(GC)
Storage Temp	Argon charged
Shipped In	Normal
Grade	analytical standard

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	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
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

Associated Targets(Human)

CES2 Tchem Carboxylesterase 2 (583 Activities)

Discover Target: CES2

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

Associated Targets(non-human)

Carboxylesterase (379 Activities)

Explore this target

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

Jhe CG8425-PA [Drosophila melanogaster] (21 Activities)

Discover Target: Jhe

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

Meloidogyne incognita (862 Activities)

Explore this target

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

Trpa1 Transient receptor potential cation channel subfamily A member 1 (1003 Activities)

Discover Target: Trpa1

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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	decan-2-one
INCHI	InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3-9H2,1-2H3
InChIKey	ZAJNGDIORYACQU-UHFFFAOYSA-N
Smiles	CCCCCCCCC(=O)C
Isomeric SMILES	CCCCCCCCC(=O)C
Molecular Weight	156.27
Beilstein	1747463
Reaxy-Rn	1747463
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1747463&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
F2210084	Certificate of Analysis	Mar 22, 2024	D139186
F2210085	Certificate of Analysis	Mar 22, 2024	D139186
H2124180	Certificate of Analysis	Jun 07, 2023	D139186

Chemical and Physical Properties

Sensitivity	air sensitive
Refractive Index	1.43
Flash Point(°F)	187°F
Flash Point(°C)	86℃
Boil Point(°C)	210-212℃
Melt Point(°C)	3℃
Molecular Weight	156.260 g/mol
XLogP3	3.700
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 Å²
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Yanmei Xi, Sana Ikram, Tong Zhao, Yiwei Shao, Ruirui Liu, Fuhang Song, Baoguo Sun, Nasi Ai. (2023) 2-Heptanone, 2-nonanone, and 2-undecanone confer oxidation off-flavor in cow milk storage. JOURNAL OF DAIRY SCIENCE, 106 (8538).
2. Tao Tang, Fanfan Wang, Houyun Huang, Nengneng Xie, Jie Guo, Xiaoliang Guo, Yuanyuan Duan, Xiaoyue Wang, Qingfang Wang, Jingmao You. (2024) Antipathogenic Activities of Volatile Organic Compounds Produced by Bacillus velezensis LT1 against Sclerotium rolfsii LC1, the Pathogen of Southern Blight in Coptis chinensis. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 72 (18): (10282-10294).
3. Yimeng Ren, Longzhu Zhou, Yujie Shi, Yanan Yu, Weihai Xing, Qingyu Zhao, Junmin Zhang, Yueyu Bai, Jing Li, Chaohua Tang. (2024) Effect of alterations in phospholipids and free fatty acids on aroma-active compounds in instant-boiled chuck tender, sirloin and silverside beef. Heliyon, 10

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