(E,Z)-3,13-Octadecadienyl acetate

Basic Information

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CAS Number

53120-26-6

Molecular Formula

C20H36O2

Molecular Weight

308.51 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

390.3±21.0 ºC (760 Torr),

Density

0.882±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

97.6±20.4 ºC,

Solubility

Insuluble (9.9E-4 g/L) (25 ºC),

Refractive Index

1.4596 (20 ºC)

SMILES

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CCCCC=CCCCCCCCCC=CCCOC(=O)C

InChI

InChI=1S/C20H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h6-7,16-17H,3-5,8-15,18-19H2,1-2H3/b7-6-,17-16+

InChIKey

VVJPJXKHBZNADP-ZSTZHTMOSA-N

LogP

6.363000000000007

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

292

Synonyms & References

English

e,z-3,13-octadecadienylacetate
CIS,TRANS-3,13-OCTADECADIENYL ACETATE
(3E,13Z)-3,13-octadecadien-1-yl acetate
(3E,13Z)-3,13-octadecadienyl acetate
(3E,13Z)-octadeca-3,13-dienyl acetate
(E,Z)-3,13-octadecadien-1-yl acetate
3(E),13(Z)-octadecadien-1-yl acetate
CTK0A9829
Cyclooctanone, 2,8-dibromo-, trans-
trans-2,8-Dibrom-cyclooctanon
trans-2,8-dibromocyclooctanone
trans-2,cis-13-octadecadien-1-yl acetate
(E,Z)-3,13-Octadecadienyl acetate
3-trans-13-cis-Octadecadienyl acetate
Isomate LPTB
Isomate P
(13Z)-OCTADECA-3,13-DIEN-1-YL ACETATE
[(3E,13Z)-octadeca-3,13-dienyl] acetate
EINECS 258-373-2
Q27271578
UNII-9393H2PNQ9
53120-26-6
3E,13Z-Octadecadienyl acetate
SCHEMBL1301571
(E,Z)-3,13-Octadecadien-1-ol acetate
ISOMATE P
3,13-Octadecadien-1-ol, acetate, (3Z,13E)-
(3E,13Z)-Octadecadien-1-yl acetate
E,Z-3,13-Octadecadien-1-ol acetate
EPA Pesticide Chemical Code 117202
AI3-36727

FAQ

What are the physical and chemical properties of (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6)?

(E,Z)-3,13-Octadecadienyl acetate is a liquid at room temperature. It has a molecular weight of approximately 284.39 g/mol. This compound is moderately soluble in common organic solvents like ethanol and acetone but less soluble in water. It is relatively stable under normal conditions but may undergo hydrolysis in the presence of water. It is reactive towards bases and behaves as an ester, which can affect its reactivity in certain chemical reactions.

How is (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6) typically synthesized?

(E,Z)-3,13-Octadecadienyl acetate is commonly synthesized through the esterification of (E,Z)-3,13-octadecadienol with acetic acid. This process can be catalyzed by a strong acid like sulfuric acid. The yield is generally around 85-90%. The reaction is exothermic and requires careful monitoring to avoid side reactions. Selectivity towards the desired stereoisomer can be achieved by using chiral catalysts.

What industries use (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6)?

(E,Z)-3,13-Octadecadienyl acetate is used in the fragrance and flavor industry due to its characteristic scent. It is also applied in the chemical industry for the synthesis of other compounds. Additionally, it has potential uses in the pharmaceutical industry as a precursor or intermediate. Its chemical properties make it suitable for applications in polymer science and as a component in sensor technology.

What precautions should be taken when handling (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6)?

When handling (E,Z)-3,13-Octadecadienyl acetate, it is essential to wear appropriate personal protective equipment (PPE) including safety goggles, gloves, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to avoid inhalation of vapors. Spills should be cleaned up immediately using appropriate absorbent materials. Always refer to the Material Safety Data Sheet (MSDS) for specific handling and disposal instructions. It is also important to ensure proper storage in a cool, dry place away from heat sources and incompatible materials.

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(E,Z)-3,13-Octadecadienyl acetate | CAS No. 53120-26-6

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Boiling Point

Density

Flash Point

Solubility

Refractive Index

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Synonyms & References

English

FAQ

What are the physical and chemical properties of (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6)?

How is (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6) typically synthesized?

What industries use (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6)?

What precautions should be taken when handling (E,Z)-3,13-Octadecadienyl acetate (CAS: 53120-26-6)?

Related Compounds

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Supplier Information

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Shanghai Yuyeh Biotechnology Co., Ltd.

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Yunnan Qi'en Biotechnology Co., Ltd.

Shanghai Yooker Mo Technology Co., Ltd.

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