Etomoxir (Na salt) - ≥99% , CAS No.828934-41-4

CAS: 828934-41-4 Cat. No.: E304730 Molecular Weight: 320.74 EC Number: 696-186-1

GRADE & PURITY ≥99%

Synonyms

FD10620 | 828934-41-4 (sodium) | J-500930 | (R)-Etomoxir sodium | s8244 | (+)-Etomoxir sodium salt | MFCD07787411 | Na salt | Etomoxir (Na salt) | E0232 | UNII-Z6MN4UHR8S | HY-50202A | (2R)-2-[6-(4-chlorophenoxy)hexyl]-2-oxiranecarboxylic acid monosodium

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

FD10620 | 828934-41-4 (sodium) | J-500930 | (R)-Etomoxir sodium | s8244 | (+)-Etomoxir sodium salt | MFCD07787411 | Na salt | Etomoxir (Na salt) | E0232 | UNII-Z6MN4UHR8S | HY-50202A | (2R)-2-[6-(4-chlorophenoxy)hexyl]-2-oxiranecarboxylic acid monosodium

Specifications & Purity

≥99%

Biochemical and Physiological Mechanisms

Irreverisble inhibitor of mitochondrial carnitine palmitoyl transferase 1 (CPT1). PPARα direct agonist. Used in fatty acid oxidation\xa0studies.

Storage

Protected from light, Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Toxic, refer to SDS for further information . Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 504771556
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504771556
• Canonical Smiles: C1C(O1)(CCCCCCOC2=CC=C(C=C2)Cl)C(=O)[O-].[Na+]
• IUPAC Name: sodium;(2R)-2-[6-(4-chlorophenoxy)hexyl]oxirane-2-carboxylate
• InChIKey: RPACBEVZENYWOL-XFULWGLBSA-M
• INCHI: 1S/C15H19ClO4.Na/c16-12-5-7-13(8-6-12)19-10-4-2-1-3-9-15(11-20-15)14(17)18;/h5-8H,1-4,9-11H2,(H,17,18);/q;+1/p-1/t15-;/m1./s1
• Isomeric SMILES: C1[C@](O1)(CCCCCCOC2=CC=C(C=C2)Cl)C(=O)[O-].[Na+]
• Molecular Weight: 320.74
• Reaxy-Rn: 6964368
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6964368&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Medium-chain fatty acids Alkyl aryl ethers Chlorobenzenes Oxirane carboxylic acids Aryl chlorides Carboxylic acid salts Oxacyclic compounds Carboxylic acids Dialkyl ethers Organic metal halides Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic sodium salts Organochlorides Organic cations
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Medium-chain fatty acid - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Fatty acid - Oxirane carboxylic acid - Oxirane carboxylic acid or derivatives - Carboxylic acid salt - Organic metal halide - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Organic alkali metal salt - Dialkyl ether - Oxirane - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carbonyl group - Organic oxygen compound - Organic sodium salt - Organic oxide - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic cation - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Light sensitive
• Molecular Weight: 320.740 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 320.079 Da
• Monoisotopic Mass: 320.079 Da
• Topological Polar Surface Area: 61.900 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 321.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Jian Chen, Zhixiang Wei, Zixuan Song, Sitong Meng, Jiaqi An, Zhenqun Zhang, Yaning Biao, Muqing Zhang, Yixin Zhang.  (2026)  Atractylodin ameliorates obesity-associated hepatic steatosis by regulating the PLIN2-ATGL/CPT1A axis-mediated lipid droplet-mitochondria interactions.  PHYTOMEDICINE,      [PMID:] [10.1016/j.phymed.2026.158134]