CAS 86362-36-9

3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate

Description:

3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate, with CAS number 86362-36-9, is a synthetic compound primarily recognized for its role as an antioxidant. This substance belongs to the class of compounds known as tocopherols and tocotrienols, which are derivatives of vitamin E. Its structure features a benzopyran ring, which contributes to its antioxidant properties by scavenging free radicals and protecting cellular components from oxidative damage. The presence of multiple methyl groups enhances its lipophilicity, allowing it to integrate well into lipid membranes. Additionally, the nicotinate moiety may provide potential benefits related to cellular metabolism and energy production. This compound is often studied for its applications in food preservation, cosmetics, and pharmaceuticals due to its stability and efficacy in preventing oxidative degradation. Overall, its unique structural characteristics and functional properties make it a valuable compound in various industrial and health-related applications.

Formula: C₃₅H₅₃NO₃

InChI: InChI=1S/C35H53NO3/c1-24(2)13-9-14-25(3)15-10-16-26(4)17-11-20-35(8)21-19-31-29(7)32(27(5)28(6)33(31)39-35)38-34(37)30-18-12-22-36-23-30/h12,18,22-26H,9-11,13-17,19-21H2,1-8H3

InChI key: InChIKey=MSCCTZZBYHQMQJ-UHFFFAOYSA-N

SMILES: CC1=C2C(=C(C)C(OC(=O)C=3C=CC=NC3)=C1C)CCC(CCCC(CCCC(CCCC(C)C)C)C)(C)O2

Synonyms:

• Nicotinic acid, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanyl ester
• 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate
• 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl 3-pyridinecarboxylate
• 3-Pyridinecarboxylic acid, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl ester
• Einecs 289-227-6
• DL-alpha-Tocopherol Nicotinate-d9
• DL-α-tocopherol nicotinate

DL-α-Tocopherol Nicotinate-d9

CAS: 86362-36-9

Formula: C₃₅H₄₄D₉NO₃

Color and Shape: White To Off-White Solid

Molecular weight: 544.87

Ref: 4Z-V-045019