CAS 106610-61-1

1-(7-Methyloctyl) 1,2-benzenedicarboxylate

Description:

1-(7-Methyloctyl) 1,2-benzenedicarboxylate, with CAS number 106610-61-1, is an organic compound that belongs to the class of phthalate esters. It features a benzenedicarboxylate structure, where two carboxylate groups are attached to a benzene ring, and is further substituted with a 7-methyloctyl group, which contributes to its hydrophobic characteristics. This compound is typically colorless to pale yellow in appearance and is known for its low volatility and moderate solubility in organic solvents. It exhibits properties such as thermal stability and resistance to degradation, making it suitable for various applications, including as a plasticizer in polymers and as an additive in formulations. Its molecular structure suggests potential interactions with biological systems, prompting studies on its environmental impact and safety profile. As with many phthalate esters, it is essential to consider regulatory guidelines regarding its use, particularly concerning human health and ecological effects.

Formula: C₁₇H₂₄O₄

InChI: InChI=1S/C17H24O4/c1-13(2)9-5-3-4-8-12-21-17(20)15-11-7-6-10-14(15)16(18)19/h6-7,10-11,13H,3-5,8-9,12H2,1-2H3,(H,18,19)

InChI key: InChIKey=RNCMBSSLYOAVRT-UHFFFAOYSA-N

SMILES: C(OCCCCCCC(C)C)(=O)C1=C(C(O)=O)C=CC=C1

Synonyms:

• 1,2-Benzenedicarboxylic acid, 1-(7-methyloctyl) ester
• 1,2-Benzenedicarboxylic acid, mono(7-methyloctyl) ester
• 1,2-Benzenedicarboxylicacid, mono(7-methyloctyl) ester (9CI)
• 1-(7-Methyloctyl) 1,2-benzenedicarboxylate
• 1-Octanol, 7-methyl-, phthalate
• 1-Octanol, 7-methyl-, phthalate (7CI)
• 2-(((7-Methyloctyl)oxy)carbonyl)benzoic acid

1,2-Benzenedicarboxylic Acid 1-(7-Methyloctyl) Ester

CAS: 106610-61-1

Formula: C₁₇H₂₄O₄

Color and Shape: Colourless To Light Yellow

Molecular weight: 292.37

Ref: TR-B185500

1,2-Benzenedicarboxylic acid 1-(7-methyloctyl) ester

CAS: 106610-61-1

The analytical method for 1,2-benzenedicarboxylic acid 1-(7-methyloctyl) ester is based on the extraction of the compound from a solid phase with a gas chromatograph. The extract is then injected into the gas chromatograph and separated by means of a column containing an adsorbent. The compounds are detected by flame ionization detectors or electron capture detectors. For this compound, the gas chromatographic column was coated with polyvinyl and fatty acid to improve sensitivity and selectivity. This method has been used in humans as well as CD-1 mice. It can also be used to measure phthalate levels in surface methodology experiments. Hydroxyl group levels are measured using solid phase microextraction techniques, which are found in matrix effect studies. Logistic regression analysis is performed to assess whether there is any correlation between gsh-px activities and histological analysis results from women who have been exposed to this compound.

Formula: C₁₇H₂₄O₄

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 292.4 g/mol

Ref: 3D-GEA61061