13231-81-7

Basic information

• Product Name: 3-METHYL-1-HEXANOL
• Synonyms: (±)-3-methyl-hexan-1-ol;3-methyl-hexan-1-ol;3-methylhexan-1-ol;3-methylhexanol;methylhexanol;3-METHYL-1-HEXANOL;1-HEXANOL,3-METHYL;3-METHYL-1-HEXANOL 96+%
• CAS NO: 13231-81-7
• Molecular Formula: C₇H₁₆O
• Molecular Weight: 116.2
• Mol File: 13231-81-7.mol
• Article Data: 6

Chemical Properties

• Melting Point: -30.45°C (estimate)
• Boiling Point: 96 °C / 41mmHg
• Flash Point: 61.8°C
• Appearance: /
• Density: 0.83
• Refractive Index: 1.4240 to 1.4270
• PKA: 15.14±0.10(Predicted)
• CAS DataBase Reference: 3-METHYL-1-HEXANOL(CAS DataBase Reference)
• NIST Chemistry Reference: 3-METHYL-1-HEXANOL(13231-81-7)
• EPA Substance Registry System: 3-METHYL-1-HEXANOL(13231-81-7)

Safety Data

• Hazardous Substances Data: 13231-81-7(Hazardous Substances Data)

Usage

Description

3-METHYL-1-HEXANOL is an organic compound that belongs to the alcohol family. It is characterized by its distinct aroma and is commonly found in various natural sources. 3-METHYL-1-HEXANOL is known for its ability to contribute to the unique scent profiles of different products.

Uses

Used in the Wine Industry:
3-METHYL-1-HEXANOL is used as an aroma component in the wine industry, specifically in Brazilian wines. Its presence contributes to the complex and rich scent profile of these wines, enhancing their overall sensory experience for consumers.
Used in the Essential Oils Industry:
3-METHYL-1-HEXANOL is also used as a component of volatile oils extracted from various plant sources, such as the aerial and underground parts of Cynanchum paniculatum. These volatile oils are often utilized in the fragrance, perfumery, and aromatherapy industries due to their distinctive scents and potential therapeutic properties.

Upstream product

• 167834-10-8 (4S)-6-(tert-butyldimethylsilyloxy)-4-methyl-1-hexanol 
• 116370-25-3 (S)-tert-butyl ((3,7-dimethyloct-6-en-1-yl)oxy)dimethylsilane 
• 7540-51-4 (S)-3,7-dimethyl-6-octen-1-ol 
• 3780-58-3 3-methylhexanoic acid 
• 188123-51-5 (1S,2R,6S,7S,8S)-8-(tert-Butyl-diphenyl-silanyloxy)-5-((S)-3-methyl-hex-5-enoyl)-3-oxa-5-aza-tricyclo[5.2.1.0^2,6]decan-4-one 
• 35666-77-4 (3S)-3-Methylhexanoic acid 
• 198956-44-4 (2S)-2-Benzylpentane 
• 455281-03-5 (S)-1-((1R,5S,7S)-10,10-Dimethyl-3,3-dioxo-3λ⁶-thia-4-aza-tricyclo[5.2.1.0^1,5]dec-4-yl)-3-methyl-hex-5-en-1-one 
• 116169-10-9 (S)-(-)-methyl 3-methylhexanoate 
• 64-17-5 ethanol 
• 118575-05-6 (S)-ethyl 3-methylhexanoate 
• 71-43-2 benzene 
• 188123-53-7 (1S,2R,6S,7S,8S)-8-(tert-Butyl-diphenyl-silanyloxy)-5-((S)-3-methyl-hexanoyl)-3-oxa-5-aza-tricyclo[5.2.1.0^2,6]decan-4-one 

Downstream Products

• 101257-63-0 (+)(S)-1-chloro-3-methyl-hexane 
• 1361023-02-0 (2R,6R,8S,3E)-1-benzyloxy-2,4,8-trimethylundec-3-en-6-ol 
• 1361022-93-6 (2R,6S,8S,3E)-1-benzyloxy-2,4,8-trimethylundec-3-en-6-ol 
• 1361022-98-1 (2R,4R,6S,8S)-2,4,8-trimethyl-1-(tri-isopropylsilyloxy)undecan-6-yl 4-methylbenzenesulfonate 
• 1361023-09-7 (2R,4S,6R,8S)-2,4,6,8-tetramethylundecyl toluene p-sulfonate 
• 1361023-08-6 [(7R,11RS,13R,15S,17R,19S)-7,13,15,17,19-pentamethyldocosan-11-yl]phenylsulfone 
• 1361023-07-5 [(7S,11RS,13R,15S,17R,19S)-7,13,15,17,19-pentamethyldocosan-11-yl](phenyl)sulfone 
• 749228-61-3 (4R)-3-((3S,5S)-(2E)-3,5-dimethyloctanoyl)-4-phenyloxazolidin-2-one 
• 749228-59-9 (4R)-3-((5S)-(2E)-methyloct-2-enoyl)-4-phenyloxazolidin-2-one 

Relevant articles and documents

Systematic comparison of sets of 13C NMR spectra that are potentially identical. Confirmation of the configuration of a cuticular hydrocarbon from the cane beetle antitrogus parvulus

A systematic process is introduced to compare 13C NMR spectra of two (or more) candidate samples of known structure to a natural product sample of unknown structure. The process is designed for the case where the spectra involved can reasonably

Toward a total synthesis of okilactomycin. 2. A metathesis-based approach to the heavily functionalized cyclohexane ring

An attempt to access in an enantioselective fashion, a highly substituted cyclohexane as required for the northeastern sector of okilactomycin is described. The application of Oppolzer's sultam chemistry, involving in particular an optically and chemicall

Enantioselective carbolithiation of β-alkylated styrene

Stoichiometric or catalytic amounts of (-) sparteine serve as promoter for enantioselective carbolithiation of β-alkylated, non functionalized styrene.