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1,6-Hexanediol, 3-methyl-, also known as 3-Methyl-1,6-hexanediol or 3-Methylhexane-1,6-diol, is an organic compound with the chemical formula C7H16O2. It is a colorless liquid with a molecular weight of 132.20 g/mol. This diol is characterized by a six-carbon chain with a methyl group attached to the third carbon and hydroxyl groups at the first and sixth carbon positions. It is used as a chemical intermediate in the synthesis of various compounds, such as plasticizers, surfactants, and other specialty chemicals. Due to its reactive hydroxyl groups, 1,6-hexanediol, 3-methyl- can undergo esterification, etherification, and other chemical reactions, making it a versatile building block in the chemical industry.

4089-71-8

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4089-71-8 Usage

Explanation

The molecular formula represents the number of atoms of each element present in a molecule of the compound.

Explanation

Describes the appearance and consistency of the compound in its pure form.

Explanation

The compound belongs to a group of organic compounds characterized by the presence of a hydroxyl (-OH) functional group.

Explanation

Lists the various applications of the compound in different industries.

Explanation

The compound has the ability to inhibit the growth of microorganisms, making it suitable for use in products that require preservation.

Explanation

Indicates that the compound has a low risk of causing harm to humans or the environment when used according to recommended guidelines.

Explanation

Describes the compound's minimal potential to cause adverse health effects when exposed to humans or animals.

Explanation

Suggests that the compound has a minimal negative effect on the environment when used and disposed of properly.

Physical State

Colorless, viscous liquid

Family

Alcohols

Uses

a. Solvent
b. Coupling agent
c. Raw material for adhesives, plastics, and coatings

Antimicrobial properties

Used in personal care and cosmetic products

Safety

Relatively safe for use

Toxicity

Low toxicity

Environmental impact

Low potential for causing environmental harm

Check Digit Verification of cas no

The CAS Registry Mumber 4089-71-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,0,8 and 9 respectively; the second part has 2 digits, 7 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 4089-71:
(6*4)+(5*0)+(4*8)+(3*9)+(2*7)+(1*1)=98
98 % 10 = 8
So 4089-71-8 is a valid CAS Registry Number.

4089-71-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name (R,S)-3-methyl-1,6-hexanediol

1.2 Other means of identification

Product number -
Other names 1,6-Hexanediol, 3-methyl-

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:4089-71-8 SDS

4089-71-8Relevant academic research and scientific papers

A phosphine-free iron complex-catalyzed synthesis of cycloalkanes: Via the borrowing hydrogen strategy

Bettoni, Léo,Gaillard, Sylvain,Renaud, Jean-Luc

, p. 12909 - 12912 (2020/11/07)

Herein we report a diaminocyclopentadienone iron tricarbonyl complex catalyzed synthesis of substituted cyclopentane, cyclohexane and cycloheptane compounds using the borrowing hydrogen strategy in the presence of various substituted primary and secondary 1,n diols as alkylating reagents. Deuterium labeling experiments confirm that the diols were the hydride source in this cascade process. This journal is

Stereoselective synthesis of alicyclic ketones: A hydrogen borrowing approach

Armstrong, Roly J.,Akhtar, Wasim M.,Frost, James R.,Christensen, Kirsten E.,Stevenson, Neil G.,Donohoe, Timothy J.

supporting information, (2019/11/13)

A highly diastereoselective annulation strategy for the synthesis of alicyclic ketones from diols and pentamethylacetophenone is described. This process is mediated by a commercially available iridium(III) catalyst, and provides efficient access to a wide range of cyclopentane and cyclohexane products with high levels of stereoselectivity. The origins of diastereoselectivity in the annulation reaction have been explored by a series of control experiments, which provides an explanation for how each stereocentre around the newly forged ring is controlled.

Direct Synthesis of Cycloalkanes from Diols and Secondary Alcohols or Ketones Using a Homogeneous Manganese Catalyst

Kaithal, Akash,Gracia, Lisa-Lou,Camp, Clément,Quadrelli, Elsje Alessandra,Leitner, Walter

supporting information, (2019/11/21)

A method for the synthesis of substituted cycloalkanes was developed using diols and secondary alcohols or ketones via a cascade hydrogen borrowing sequence. A non-noble and air-stable manganese catalyst (2 mol %) was used to perform this transformation. Various substituted 1,5-pentanediols (3-4 equiv) and substituted secondary alcohols (1 equiv) were investigated to prepare a collection of substituted cyclohexanes in a diastereoselective fashion. Similarly, cyclopentane, cyclohexane, and cycloheptane rings were constructed from substituted 1,4-butanediol, 1,5-pentanediol, and 1,6-hexanediol, and sterically hindered ketones following a (4 + 1), (5 + 1), and (6 + 1) strategy, respectively. This reaction provides an atom economic methodology to construct two C-C bonds at a single carbon center generating high-value cycloalkanes from readily available alcohols as feedstock using an earth-abundant metal catalyst.

Lactones 34 [1]. Application of alcohol dehydrogenase from horse liver (HLADH) in enantioselective synthesis of δ- and ε-lactones

Boratynski, Filip,Kielbowicz, Grzegorz,Wawrzenczyk, Czeslaw

experimental part, p. 30 - 36 (2010/12/18)

The ability of horse liver alcohol dehydrogenase (HLADH) to the enantioselective oxidation of primary-primary, primary-secondary and primary-tertiary aliphatic 1,5- and 1,6-diols 1a-i was studied. No enantioselectivity of the transformations of primary-primary 1,6-diols 1a-d to ε-lactones 4a-d was observed. Regioselective oxidation of primary-secondary 1,6-diols 1e,f and 1,5-diols 1h,i afforded enantiomerically enriched ε-lactones 4e,f and δ-lactones 4h,i. ε-Lactones 4e,f were formed with higher enantiomeric excesses (e.e. = 85-99%). Enzymatic oxidation of primary-tertiary 1,6-diol 1g did not give lactone product.

SYNTHESIS AND LIQUID-CRYSTALLINE PROPERTIES OF NEW CHIRAL POLYESTERS WITH AROMATIC TRIAD MESOGEN AND SPACER OF DIFFERENT OPTICAL PURITY

Farah, Abdiaziz Ali,Galli, Giancarlo,Chiellini, Emo,Gallot, Bernard

, p. 279 - 284 (2007/10/02)

A series of new chiral liquid-crystalline polyesters 1-x, comprising a terephthalate-methylhydroquinone-terephthalate mesogen and an (R)-3-methyl-1,6-hexanediyl spacer segment of varying optical purity, x (0, 20, 50, 70, or 95percent) has been prepared and studied with respect to the thermotropic properties.The polyesters were synthesized by direct polycondensation of a diacid and a diphenol in pyridine solution at 120 deg C in the presence of p-tosyl chloride as a condensing agent and dimethylformamide as an activator.High molecular weights (Mw = 61,000-73,000, by SEC) and narrow molecular weight distributions (Mw/Mn = 1.1-2.4) were obtained for all of the polyesters.Depending on the optical purity of the spacer, a nematic or a chiral nematic mesophase was formed that extended over a very broad range between the glass and the isotropization temperatures (Tg-Ti >= 179 deg C).X-Ray diffraction patterns proved the chiral mesophase to remain frozen-in in the glassy state.Polyesters 1-x appear to be suitable candidates for electro-optical investigations in the unwound chiral nematic mesophase.

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