CAS 95809-78-2

6,8-Bis[(phenylmethyl)thio]octanoic acid

Description:

6,8-Bis[(phenylmethyl)thio]octanoic acid is an organic compound characterized by its long hydrocarbon chain and the presence of thioether functional groups. The structure features two phenylmethylthio groups attached to the octanoic acid backbone, which contributes to its unique chemical properties. This compound is likely to exhibit hydrophobic characteristics due to the long alkyl chain, while the phenyl groups can provide additional aromatic interactions. The thioether linkages may influence its reactivity and solubility in various solvents. As a fatty acid derivative, it may participate in biochemical processes or serve as a surfactant or emulsifier in industrial applications. Its specific applications and behavior in biological systems would depend on its interactions with other molecules, including proteins and membranes. Safety data and handling precautions should be considered, as with any chemical substance, particularly those with potential biological activity or toxicity.

Formula: C₂₂H₂₈O₂S₂

InChI: InChI=1S/C22H28O2S2/c23-22(24)14-8-7-13-21(26-18-20-11-5-2-6-12-20)15-16-25-17-19-9-3-1-4-10-19/h1-6,9-12,21H,7-8,13-18H2,(H,23,24)

InChI key: InChIKey=ZYRLHJIMTROTBO-UHFFFAOYSA-N

SMILES: C(SCC1=CC=CC=C1)(CCSCC2=CC=CC=C2)CCCCC(O)=O

Synonyms:

• CPI 613
• Devimistat
• Octanoic acid, 6,8-bis[(phenylmethyl)thio]-
• 6,8-Bis[(phenylmethyl)thio]octanoic acid
• Octanoic acid, 6,8-bis(benzylthio)-

Octanoic acid, 6,8-bis[(phenylMethyl)thio]-

CAS: 95809-78-2

Formula: C₂₂H₂₈O₂S₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 388.5865

Ref: IN-DA00IJGH

6,8-Bis(Benzylthio)Octanoic Acid

CAS: 95809-78-2

6,8-Bis(Benzylthio)Octanoic Acid

Purity: 98%

Molecular weight: 388.59g/mol

Ref: 54-OR1011971

Devimistat

CAS: 95809-78-2

Devimistat

Purity: ≥98%

Molecular weight: 388.59g/mol

Ref: 54-BUP13250

6,8-Bis(benzylthio)octanoic Acid

CAS: 95809-78-2

Formula: C₂₂H₂₈O₂S₂

Purity: >98.0%(T)(HPLC)

Color and Shape: White to Light yellow powder to crystal

Molecular weight: 388.58

Ref: 3B-B5368

Devimistat

CAS: 95809-78-2

Devimistat (6,8-Bis(benzylthio)octanoic acid) , a lipoate analog, inhibits mitochondrial enzymes pyruvate dehydrogenase (PDH) and α-ketoglutarate dehydrogenase

Formula: C₂₂H₂₈O₂S₂

Purity: 98.06% - 99.24%

Color and Shape: Solid

Molecular weight: 388.59

Ref: TM-T6157

CPI 613

CAS: 95809-78-2

Applications CPI 613 is a class of non-redox-active lipoate derivative that disrupts cancer cell mitochondrial metabolism and are potent anticancer agents in vivo.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Zachar, Z. et al.: J. Mol. Med., 89, 1137 (2011); Lee, K. et al.: Drug Met. Lett., 5, 163 (2011)

Formula: C₂₂H₂₈O₂S₂

Color and Shape: Off White Crystalline Powder

Molecular weight: 388.59

Ref: TR-C781440