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Diethylhexanoic acid, also known as 2,2-diethylhexanoic acid, is a chemical compound that is commonly found as a pollutant in anaerobic environments, such as river sediments.

4528-37-4

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4528-37-4 Usage

Uses

Used in Environmental Applications:
Diethylhexanoic acid is used as a pollutant indicator for assessing the level of contamination in river sediments. Its presence can provide valuable information on the health of aquatic ecosystems and the need for environmental remediation efforts.
Used in Research and Analysis:
Diethylhexanoic acid can be used as a research subject to study the behavior and effects of pollutants in anaerobic environments. This can help scientists better understand the impact of such contaminants on the environment and develop strategies for their removal or mitigation.

Synthesis Reference(s)

Journal of the American Chemical Society, 78, p. 3837, 1956 DOI: 10.1021/ja01596a076

Check Digit Verification of cas no

The CAS Registry Mumber 4528-37-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,5,2 and 8 respectively; the second part has 2 digits, 3 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 4528-37:
(6*4)+(5*5)+(4*2)+(3*8)+(2*3)+(1*7)=94
94 % 10 = 4
So 4528-37-4 is a valid CAS Registry Number.
InChI:InChI=1/C10H20O2/c1-4-7-8-10(5-2,6-3)9(11)12/h4-8H2,1-3H3,(H,11,12)

4528-37-4SDS

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 2,2-DIETHYLHEXANOIC ACID

1.2 Other means of identification

Product number -
Other names Diaethyl-butyl-essigsaeure

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:4528-37-4 SDS

4528-37-4Downstream Products

4528-37-4Relevant academic research and scientific papers

Platinum complexes of single isomer neoalkyl acids

-

, (2008/06/13)

This invention relates to pure single isomers of neoalkyl carboxylic acids and platinum complexes comprising the single isomer neoacids. The use of liposomes incorporating these complexes and used in anti-tumor chemotherapy is also described. A particularly preferred liposomal formulation comprising a saturated phosphatidylcholine is described.

Pseudo One-Step Cleavage of C-C Bonds in the Decomposition of Ionized Carboxyclic Acids. Radical Like Reactions in Mass Spectrometry

Weiske, Thomas,Schwarz, Helmut

, p. 323 - 347 (2007/10/02)

Metastable molecular ions of hexanoic acid (1) decompose unimolecularly to C2H5. and protonated methacrylic acid (5-H+)(92percent rel. abund.).Investigation of the mechanism reveals that 1) the branched cation radical 11 must be regarded as the essential intermediate in the course of the rearrangement/dissociation reaction and 2) the process commences with intramolecular hydrogen transfer from either C-3 or C-5 to the ionized carbonyl oxygen ("hidden" hydrogen migration).Hydrogen transfer from C-4, which would correspond to the well-known McLafferty rearrangement, is of no importance in the C2H5.-elimination from 1.The same conclusion applies for various alternative mechanisms, as for example a SRi type reaction, 1 -> 2-H+.The gas phase chemistry of the cation radical of 1, and in particular the hydrogen exchange processes between the methylene groups C-2/C-3 and C-5/C-6, is in surprisingly close correspondence to the chemistry of free alkyl radicals. - The syntheses of various 13C and 2H-labelled model compounds are described.

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