40780-64-1

Basic information

• Product Name: 3-HEXYL ACETATE
• Synonyms: 3-HEXYL ACETATE
• CAS NO: 40780-64-1
• Molecular Formula: C₈H₁₆O₂
• Molecular Weight: 144.21
• Mol File: 40780-64-1.mol

Chemical Properties

• Boiling Point: 149.999°C at 760 mmHg
• Flash Point: 46.729°C
• Appearance: /
• Density: 0.877g/cm³
• Vapor Pressure: 3.922mmHg at 25°C
• Refractive Index: 1.411
• CAS DataBase Reference: 3-HEXYL ACETATE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-HEXYL ACETATE(40780-64-1)
• EPA Substance Registry System: 3-HEXYL ACETATE(40780-64-1)

Safety Data

• RIDADR: 1993
• HazardClass: 3.2
• PackingGroup: III
• Hazardous Substances Data: 40780-64-1(Hazardous Substances Data)

Usage

InChI:InChI=1/C8H16O2/c1-4-6-8(5-2)10-7(3)9/h8H,4-6H2,1-3H3

Upstream product

• 592-41-6 1-hexene 
• 64-19-7 acetic acid 
• 108-05-4 vinyl acetate 
• 592-43-8 2-hexene 
• 110-54-3 hexane 
• 108-24-7 acetic anhydride 
• 546-67-8 lead(IV) tetraacetate 

Downstream Products

• 13471-42-6 (R)-3-hexanol 
• 6210-51-1 (S)-3-hexanol 
• 589-38-8 n-hexan-3-one 
• 623-37-0 n-hexan-3-ol 
• 7642-09-3 cis-3-hexene 
• 13269-52-8 trans-3-Hexene 
• 7688-21-3 cis-2-hexene 
• 4050-45-7 trans-2-hexene 

Relevant articles and documents

Hydroacetoxylation of olefins with acetic acid genetated in situ from vinyl acetate in the presence of ruthenium complexes

Ruthenium complexes catalyze the decomposition of vinyl acetate releasing the acetic acid and its subsequent addition to linear and cyclic olefins.

Alkane reaction with a mixture of nitric acid and acetic anhydride

Alkanes C6-C10 at 15-20°C react with a mixture of concentrated HNO3 and acetic anhydride to afford nitrates of secondary alcohols in the yield up to 70%. Acetates of secondary alcohols, acetates and nitrates of β-nitroalcohols form in small quantity. Isooctane reacts under milder conditions to give a nitrate of β-nitroalcohol.

A NEW COMBINED OXIDIZING REAGENT SYSTEM, Fe(CH3CN)6(3+)-IO4(1-): OXIDATION OF PARAFFIN HYDROCARBONS

Combined oxidizing reagent systems of Fe(AN)6ClO4)3 ( AN = acetonitrile ) with halogen oxyacids were investigated.In particular, reactions of paraffin hydrocarbons with a combined reagent system of Fe(AN)6(3+) were explored because of the high reactivity of this system in the oxidation of adamantane ( Table 1 ).Oxidation of bornane, norbornane, cyclohexane, and n-hexane gave the corresponding acetamides and acetates ( Tabla II ).These results shows that the title reagent system can efficiently oxidize organic substrates which have onset potentials of anodic current of ca. 2.7 V vs. saturated calomel electrode.Keywords - oxidation; paraffin hydrocarbon; combined reagent system; hexakisacetonitrile iron(III) perchlorate; halogen oxyacid; sodium periodate

Synthesis, Characterization, and Catalytic Activity of Beidellite-Montmorillonite Layered Silicates and their Pillared Analogues

A synthetic beidellite-smectite, characterized by a range of techniques, including high-resolution 27Al and 29Si solid-state n.m.r. spectroscopy, shows interesting catalytic activity (in secondary amine formation from cyclohexylamine, in ester production from hex-1-ene and acetic acid, and in ether synthesis from pentanol): the selectivities differ significantly from those of montmorillonite-smectites.

SELECTIVE OXIDATION OF n-ALKANES WITH LEAD TETRAACETATE

Alkanes, when treated with lead tetraacetate under thermal or photochemical conditions, undergo a slow but highly selective oxidation to form secondary acetates.

Chemical Conversions using Sheet Silicates: Facile Ester Synthesis by Direct Addition of Acids to Alkenes

Ethene and acetic acid react in the interlamellar regions of certain cation (e.g.Al3+)-exchanged montmorillonites to yield ethyl acetate as the sole product, and a variety of carboxylic acids readily add to C2-C8 alkenes at temperatures above 100 deg C to yield the corresponding esters in high and selective yields.