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817-46-9

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817-46-9 Usage

General Description

2-propylhexan-1-ol, also known as 2-n-propyl-1-hexanol, is a chemical compound with the molecular formula C9H20O. It is a colorless, water-insoluble liquid with a mild, floral odor. 2-propylhexan-1-ol is commonly used as a fragrance ingredient in perfumes and personal care products. It is also utilized as a solvent in various industrial applications, such as in the production of adhesives, coatings, and cleaning products. 2-propylhexan-1-ol is derived from natural sources as well as being synthetically produced, and it is considered to have low toxicity with limited adverse health effects. However, like any chemical, proper handling and safety measures should be taken during its use and storage.

Check Digit Verification of cas no

The CAS Registry Mumber 817-46-9 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 8,1 and 7 respectively; the second part has 2 digits, 4 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 817-46:
(5*8)+(4*1)+(3*7)+(2*4)+(1*6)=79
79 % 10 = 9
So 817-46-9 is a valid CAS Registry Number.
InChI:InChI=1/C9H20O/c1-3-5-7-9(8-10)6-4-2/h9-10H,3-8H2,1-2H3

817-46-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-propylhexan-1-ol

1.2 Other means of identification

Product number -
Other names EINECS 212-443-9

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:817-46-9 SDS

817-46-9Synthetic route

(+/-)-2-n-propylhexanoic acid
3274-28-0

(+/-)-2-n-propylhexanoic acid

2-propylhexanol
817-46-9

2-propylhexanol

Conditions
ConditionsYield
With lithium aluminium tetrahydride
pentanal
110-62-3

pentanal

butyraldehyde
123-72-8

butyraldehyde

A

2-propylheptan-1-ol
10042-59-8

2-propylheptan-1-ol

B

2-Ethylhexyl alcohol
104-76-7

2-Ethylhexyl alcohol

C

2-propylhexanol
817-46-9

2-propylhexanol

D

2-ethylheptanol
817-60-7

2-ethylheptanol

Conditions
ConditionsYield
Stage #1: pentanal; butyraldehyde With sodium hydroxide In water at 20 - 130℃; for 3.25h;
Stage #2: With hydrogen In water
2-propylhexanol
817-46-9

2-propylhexanol

4-bromomethyl-octane
98956-16-2

4-bromomethyl-octane

Conditions
ConditionsYield
With phosphorus tribromide

817-46-9Downstream Products

817-46-9Relevant articles and documents

Iridium-Catalyzed Domino Hydroformylation/Hydrogenation of Olefins to Alcohols: Synergy of Two Ligands

Beller, Matthias,Huang, Weiheng,Jackstell, Ralf,Jiao, Haijun,Tian, Xinxin

supporting information, (2022/01/13)

A novel one-pot iridium-catalyzed domino hydroxymethylation of olefins, which relies on using two different ligands at the same time, is reported. DFT computation reveals different activities for the individual hydroformylation and hydrogenation steps in the presence of mono- and bidentate ligands. Whereas bidentate ligands have higher hydrogenation activity, monodentate ligands show higher hydroformylation activity. Accordingly, a catalyst system is introduced that uses dual ligands in the whole domino process. Control experiments show that the overall selectivity is kinetically controlled. Both computation and experiment explain the function of the two optimized ligands during the domino process.

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