35926-04-6

Basic information

• Product Name: 1-HEXEN-3-YL ACETATE
• Synonyms: 1-hexen-3-ol,acetate;1-HEXEN-3-YL ACETATE;1-propylallyl acetate;Acetic acid 1-ethenylbutyl ester;Acetic acid 1-propylallyl ester;Acetic acid 1-vinylbutyl ester
• CAS NO: 35926-04-6
• Molecular Formula: C₈H₁₄O₂
• Molecular Weight: 142.2
• EINECS: 252-794-5
• Mol File: 35926-04-6.mol
• Article Data: 11

Chemical Properties

• Boiling Point: 164.621 °C at 760 mmHg
• Flash Point: 55.421 °C
• Appearance: /
• Density: 0.891 g/cm³
• Vapor Pressure: 1.95mmHg at 25°C
• Refractive Index: 1.422
• CAS DataBase Reference: 1-HEXEN-3-YL ACETATE(CAS DataBase Reference)
• NIST Chemistry Reference: 1-HEXEN-3-YL ACETATE(35926-04-6)
• EPA Substance Registry System: 1-HEXEN-3-YL ACETATE(35926-04-6)

Safety Data

• Hazardous Substances Data: 35926-04-6(Hazardous Substances Data)

Usage

General Description

1-HEXEN-3-YL ACETATE, also known as hex-3-enyl acetate or leaf alcohol acetate, is a clear, colorless liquid with a fruity, green apple-like odor. It is commonly used as a flavoring agent in food and beverages, and as a fragrance ingredient in perfumes and personal care products. Its pleasant aroma makes it a popular choice for adding a sweet, fruity note to various products. Additionally, 1-HEXEN-3-YL ACETATE is used in the production of synthetic flavors and is known for its high stability and shelf life. However, it should be handled and stored with care, as it can be irritating to the skin and eyes in high concentrations.

InChI:InChI=1/C8H14O2/c1-4-6-8(5-2)10-7(3)9/h5,8H,2,4,6H2,1,3H3

Upstream product

• 64-19-7 acetic acid 
• 611182-31-1 (Z)-2-hexen-1-yl trichloroacetimidate 
• 1826-67-1 vinyl magnesium bromide 
• 108-24-7 acetic anhydride 
• 123-72-8 butyraldehyde 
• 4798-44-1 1-hexene-3-ol 
• 54684-73-0 3-bromo-1-hexene 
• 127-09-3 sodium acetate 
• 592-41-6 1-hexene 
• 107-71-1 tert-butyl peroxyacetate 
• 75-36-5 acetyl chloride 
• 92315-15-6 trans-1-methylcarbonyloxy-2-hexene oxide 
• 2497-18-9 (E)-2-hexen-1-yl acetate 

Downstream Products

• 2497-18-9 (E)-2-hexen-1-yl acetate 
• 56922-75-9 (Z)-Hex-2-en-1-yl acetate 
• 1578259-22-9 (E)-1-(2,5-dimethoxyphenyl)hex-1-en-3-yl acetate 

Relevant articles and documents

Ascaroside Signaling in the Bacterivorous Nematode Caenorhabditis remanei Encodes the Growth Phase of Its Bacterial Food Source

A novel class of species-specific modular ascarosides that integrate additional fatty acid building blocks was characterized in the nematode Caenorhabditis remanei using a combination of HPLC-ESI-(-)-MS/MS precursor ion scanning, microreactions, HR-MS/MS, MSn, and NMR techniques. The structure of the dominating component carrying a cyclopropyl fatty acid moiety was established by total synthesis. Biogenesis of this female-produced male attractant depends on cyclopropyl fatty acid synthase (cfa), which is expressed in bacteria upon entering their stationary phase.

Regioselective Asymmetric Allylic Alkylation Reaction of α -Cyanoacetates Catalyzed by a Heterobimetallic Platina-/Palladacycle

Allylic substitution reactions provide a valuable tool for the functionalization of CH acidic pronucleophiles. Often, control over the stereocenter generated at the nucleophilic reactant is still a challenge. The majority of studies that address this issue employ metal complexes with a low metal oxidation state (e.g. Pd0) to form allyl complexes through oxidative addition. In this article we describe the use of heterobimetallic PtII/PdII complexes, which probably activate the olefinic substrates through an SN2′ pathway. The reaction of α-cyanoacetates delivers linear allylation products with exclusive regioselectivity and high E/Z-selectivity for the new C=C double bond. Although the enantioselectivities attained are moderate, they are significantly higher than with related mono-PdII or -PtII catalysts or the corresponding bis-PdII complex, which indicates cooperation of the different metals. Control experiments suggest simultaneous activation of both reaction partners.