27644-04-8

Basic information

• Product Name: 3,3,6-trimethylhepta-1,5-dien-4-ol
• Synonyms: 3,3,6-trimethylhepta-1,5-dien-4-ol;3,3,6-Trimethyl-1,5-heptadien-4-ol
• CAS NO: 27644-04-8
• Molecular Formula: C₁₀H₁₈O
• Molecular Weight: 154.24932
• EINECS: 248-589-5
• Mol File: 27644-04-8.mol
• Article Data: 11

Chemical Properties

• Boiling Point: 214.3 °C at 760 mmHg
• Flash Point: 78.5 °C
• Appearance: /
• Density: 0.856 g/cm³
• Vapor Pressure: 0.0345mmHg at 25°C
• Refractive Index: 1.461
• PKA: 14.65±0.20(Predicted)
• CAS DataBase Reference: 3,3,6-trimethylhepta-1,5-dien-4-ol(CAS DataBase Reference)
• NIST Chemistry Reference: 3,3,6-trimethylhepta-1,5-dien-4-ol(27644-04-8)
• EPA Substance Registry System: 3,3,6-trimethylhepta-1,5-dien-4-ol(27644-04-8)

Safety Data

• Hazardous Substances Data: 27644-04-8(Hazardous Substances Data)

Usage

General Description

3,3,6-trimethylhepta-1,5-dien-4-ol is a chemical compound that belongs to the class of alcohols. With a molecular formula of C10H18O, it is a colorless liquid with a fruity odor. It is commonly used as a fragrance ingredient in perfumes and other cosmetic products. 3,3,6-trimethylhepta-1,5-dien-4-ol is also a potential precursor for the synthesis of other chemicals and is used in the manufacturing of various products, including pharmaceuticals and food flavorings. Additionally, it is important to handle this chemical with care as it may cause irritation to the skin, eyes, and respiratory system, and proper safety precautions should be taken when handling or using this compound.

InChI:InChI=1/C10H18O/c1-6-10(4,5)9(11)7-8(2)3/h6-7,9,11H,1H2,2-5H3

Upstream product

• 3465-88-1 (-)-4-acetoxy-3,3,6-trimethyl-hepta-1,5-diene 
• 107-86-8 3,3-dimethyl acrylaldehyde 
• 870-63-3 prenyl bromide 
• 14309-15-0 phenyl prenyl ether 
• 5362-50-5 4-methyl-3-penten-1-al 
• 546-49-6 artemisia ketone 
• 141550-13-2 4,4,5,5-tetramethyl-2-(3-methylbut-2-enyl)-1,3,2-dioxaborolane 
• 1187817-21-5 4,4,5,5-tetramethyl-2-(3-methylbut-3-en-1-yl)-1,3,2-dioxaborolane 
• 556-82-1 3-methyl-2-buten-1-ol 
• 29917-94-0 2-methylprop-1-enyllithium 
• 122016-68-6 (3-Methyl-but-2-enyloxymethanesulfonyl)-benzene 
• 89487-33-2 prenylmagnesium bromide 
• 72863-21-9 (dimethyl-1,1 propene-2 yl) sulfonyl-1 methyl-4 benzene 
• 26902-25-0 3-methyl-1-(3-methylbut-2-enyloxy)but-2-ene 

Downstream Products

• 110490-36-3 3,5-dinitro-benzoic acid-(1-isobutyl-2,2-dimethyl-butyl ester) 
• 107414-11-9 3,5-dinitro-benzoic acid-(3-methyl-1-tert-pentyl-but-2-enyl ester) 
• 107821-18-1 (+/-)-3c-(1,1-dimethyl-allyl)-5-methyl-cyclohex-4-ene-1r,2c-dicarboxylic acid 
• 29548-02-5 2,5,5-trimethyl-1,3,6-heptatriene 

Relevant articles and documents

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Allylic Sulfones as Allyl Anion Equivalents: Homoallylic Alcohols from Metal Catalysed Reactions of Sulfones with Aldehydes and Ketones

Reduction of allylic sulfones with diethylzinc, catalysed by palladium(0), gives nucleophilic organometallic species, which react in situ with carbonyl compounds to give homoallylic alcohols in high yield.

Oxalic acid catalyzed isoprenic coupling: a simple experimental procedure.

Oxalic acid, which is considered as a mild acid, allows a smooth dehydration- without polymerisation- of 2-methylbut-3-en-2-ol 1 into isoprene with around 46percent yield.The remander of the reaction mixture featuring a nice fragance, consists of a mixture of 25 identified products composed of a set of cyclic and non cyclic ethers, and of monoterpenes.Fourteen products could be isolated by preparative vapor phase chromattography and identified with authentic products by 1H and 13C NMR.The formation of the observed products can be rationalized on the basis of currently admitted reaction mechanisms. Key words: isoprene / isoprene coupling / monoterpenic alcohols