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Linalyl acetate

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Identification
Molecular formula
C12H20O2
CAS number
115-95-7
IUPAC name
(1,5-dimethyl-1-vinyl-hex-4-enyl) acetate
State
State

Under standard conditions, linalyl acetate is in a liquid state. It is known for its volatility, being part of the ester family, which contributes to its prominent use in aroma compounds and fragrances.

Melting point (Celsius)
-79.00
Melting point (Kelvin)
194.15
Boiling point (Celsius)
220.00
Boiling point (Kelvin)
493.15
General information
Molecular weight
196.29g/mol
Molar mass
196.2910g/mol
Density
0.8980g/cm3
Appearence

Linalyl acetate is a colorless liquid with a pleasant floral fragrance. It is often found as a component in essential oils and is used in the perfume industry for its agreeable scent. It remains clear and stable under standard conditions.

Comment on solubility

Solubility of (1,5-Dimethyl-1-vinyl-hex-4-enyl) Acetate

(1,5-Dimethyl-1-vinyl-hex-4-enyl) acetate, a complex organic compound, presents some intriguing characteristics when it comes to solubility. The solubility of such esters is often influenced by both their size and the functional groups present.

  • General Solubility: This compound is likely to be soluble in organic solvents such as ethanol, acetone, and other nonpolar solvents. However, its solubility in water is expected to be quite low due to its hydrophobic hydrocarbon chains.
  • Factors Influencing Solubility:
    • Hydrophobic Interactions: The long hydrocarbon tails contribute to hydrophobicity, which reduces solubility in polar solvents.
    • Size of the Molecule: As with many large organic molecules, an increase in molecular size often leads to decreased solubility in water.
    • Functional Groups: The acetate functional group can favor solubility in polar organic solvents while still being insufficient for solubility in water.
  • Practical Implications: Understanding the solubility of (1,5-dimethyl-1-vinyl-hex-4-enyl) acetate is essential for its applications in fragrance, flavoring, and chemical synthesis.

In summary, while (1,5-dimethyl-1-vinyl-hex-4-enyl) acetate demonstrates some solubility in organic solvents, its overall hydrophobic nature renders it insoluble in water. This characteristic holds significant relevance in both industrial applications and laboratory practices.

Interesting facts

Interesting Facts about (1,5-Dimethyl-1-vinyl-hex-4-enyl) Acetate

(1,5-Dimethyl-1-vinyl-hex-4-enyl) acetate is a fascinating compound with unique properties and applications. Here are some captivating aspects to consider:

  • Chemical Structure: This compound features a complex structure that embodies a vinyl group, making it highly reactive and versatile in organic synthesis.
  • Applications: It finds applications in the fragrance industry due to its pleasant aroma, which makes it an excellent candidate for producing scented products.
  • Polymer Chemistry: Being a vinyl derivative, it can be polymerized to create various materials, leading to the development of new polymers with desirable features.
  • Natural Inspiration: Many compounds like this one are inspired by natural substances, mimicking scents found in flowers and fruits, which play a role in both nature and industry.
  • Synthesis Techniques: The synthesis of (1,5-dimethyl-1-vinyl-hex-4-enyl) acetate can involve several methods, including esterification reactions, showcasing the creativity and ingenuity in organic chemistry.

This compound's versatility not only highlights the breadth of organic chemistry but also the intricate relationship between chemical structure and its applications in daily life. As you explore the realms of synthetic chemistry, remember that compounds like (1,5-dimethyl-1-vinyl-hex-4-enyl) acetate represent the endless possibilities and innovative advancements within the field.

Synonyms
LINALYL ACETATE
115-95-7
Linalool acetate
Bergamiol
Bergamol
3,7-dimethylocta-1,6-dien-3-yl acetate
Lynalyl acetate
Linalol acetate
Licareol acetate
Acetic acid linalool ester
3,7-Dimethyl-1,6-octadien-3-yl acetate
1,6-Octadien-3-ol, 3,7-dimethyl-, acetate
3,7-Dimethyl-1,6-octadien-3-ol acetate
1,6-Octadien-3-ol, 3,7-dimethyl-, 3-acetate
Ex bois de rose (synthetic)
FEMA No. 2636
Linalyl acetate (natural)
NSC 2138
HSDB 644
Phanteine
Dehydrolinalool, acetate
EINECS 204-116-4
EINECS 254-806-4
UNII-5K47SSQ51G
MFCD00008907
5K47SSQ51G
3,7-Dimethyl-1,6-ctadien-3-ol acetate
DTXSID7026946
AI3-00941
NSC-2138
(1)-1,5-Dimethyl-1-vinylhex-4-enyl acetate
LINALOOL ACETATE, DL-
DTXCID006946
CHEBI:78333
EC 204-116-4
LINALYL ACETATE, (+/-)-
LINALOYL ACETATE, (+/-)-
1,5-Dimethyl-1-vinyl-4-hexenyl acetate
1,5-dimethyl-1-vinylhex-4-en-1-yl acetate
LINALYL ACETATE (USP-RS)
LINALYL ACETATE [USP-RS]
Aetic Acid Linalool Ester
CAS-115-95-7
LINALYL ACETATE SYNTHETIC
(+)-1,5-Dimethyl-1-vinylhex-4-enyl acetate
(+-)-Linalyl acetate
Acetic acid-linalyl ester
CHEBI:6469
linaloyl acetate
rac-3,7-dimethylocta-1,6-dien-3-yl acetate
(+-)-3,7-dimethylocta-1,6-dien-3-yl acetate
(-)-S-Linalyl acetate
(+/-)-linalyl acetate
(1,5-dimethyl-1-vinyl-hex-4-enyl) acetate
Linalyl acetate (Standard)
3,6-octadien-3-ol acetate
3,6-octadien-3-yl acetate
SCHEMBL58028
(.+/-.)-Linalyl acetate
LINALYL ACETATE [MI]
Linalyl acetate Ex Petitgrain
LINALYL ACETATE [FCC]
Linalyl acetate Synthetic FCC
UNII: 5K47SSQ51G
1, 3,7-dimethyl-, acetate
LINALYL ACETATE [FHFI]
LINALYL ACETATE [HSDB]
CHEMBL502773
WLN: 1Y&U3Y1U1OV1
FEMA 2636
HY-N6948R
NSC2138
Linalyl acetate, natural, >=80%
HY-N6948
Linalyl acetate, analytical standard
Tox21_201306
Tox21_303134
AKOS015901735
Linalyl acetate, >=97%, FCC, FG
CS-W010587
3,7-dimethyl-1,6octadien-3-yl acetate
NCGC00164001-01
NCGC00164001-02
NCGC00257047-01
NCGC00258858-01
1,5-Dimethyl-1-vinylhex-4-enyl acetate
AC-20000
BS-49383
FL156882
L0049
NS00010320
Salvia desoleana Atzei & Picci essential oil.
3,7-Dimethyl-acetate(3R)-1,6-Octadien-3-ol
E80781
1,6-Octadien-3-ol, 3, 7-dimethyl-, acetate
3,7-Dimethyl-1,6-octadien-3-yl acetate, 97%
EN300-7444436
3,7-Dimethyl-3-acetate(3R)-1,6-Octadien-3-ol
Q188314
Flavor and Extract Manufacturers' Association No. 2636
Z1255415454
Acetic acid-linalyl ester 1000 microg/mL in Acetonitrile
204-116-4