Decyl acetate - ≥98% , CAS No.112-17-4

CAS: 112-17-4 Cat. No.: D110165 분자식: C₁₂H₂₄O₂ 분자량: 200.32 EC 번호: 203-942-2

등급 & 순도 ≥98%

Synonyms

1- DECANOL ACETATE|Acetate C-10|DECYL ACETATE [FHFI]|n-Decyl acetate|Decanyl acetate|Decyl alcohol, acetate (6CI)|Acetic acid, decyl ester|Decyl ethanoate|DECYL ACETATE|Decanol acetate|Acetic Acid Decyl Ester|1-Decanol acetate|Decyl alcohol, acetate|n-Decyl ethanoate|Acetic acid, n-decyl ester|1-Decyl acetate|Decyl ester of acetic acid|DECYLACETATE

Storage

Room temperature

Shipped In

Normal

사양

동의어

1- DECANOL ACETATE | Acetate C-10 | DECYL ACETATE [FHFI] | n-Decyl acetate | Decanyl acetate | Decyl alcohol, acetate (6CI) | Acetic acid, decyl ester | Decyl ethanoate | DECYL ACETATE | Decanol acetate | Acetic Acid Decyl Ester | 1-Decanol acetate | Decyl alcohol, acetate | n-Decyl ethanoate | Acetic acid, n-decyl ester | 1-Decyl acetate Show more

사양 및 순도

≥98%

보관 조건

Room temperature

배송

Normal

순수함

≥98%

이름과 식별자

Pubchem Sid

488180711

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180711

정식 스마일

CCCCCCCCCCOC(=O)C

IUPAC Name

decyl acetate

InChIKey

NUPSHWCALHZGOV-UHFFFAOYSA-N

INCHI

1S/C12H24O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h3-11H2,1-2H3

이성체 SMILES

CCCCCCCCCCOC(=O)C

WGK 독일

2

RTECS

AG5235000

분자량

200.32

Reaxy-Rn

1762123

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1762123&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 분류 Fatty Acyls
      • Subclass Fatty alcohol esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 분류: Fatty Acyls
• Subclass: Fatty alcohol esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohol esters
• Alternative Parents: Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as fatty alcohol esters. These are ester derivatives of a fatty alcohol.
• External Descriptors: Wax monoesters

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Insoluble in water
• 굴절률: 1.427
• 발화점(°F): 113 °C
• 발화점(°C): 113°C
• 끓는점(°C): 126-127°C
• 분자량: 200.320 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 200.178 Da
• Monoisotopic Mass: 200.178 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 132.000
• 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥98% 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 112-17-4, the molecular formula is C12H24O2, and the molecular weight is 200.32 g/mol. InChIKey NUPSHWCALHZGOV-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.