CAS 88489-61-6

Methyl 3-[(1,1,2,2,3,3,3-heptafluoropropyl)thio]benzoate

Description:

Methyl 3-[(1,1,2,2,3,3,3-heptafluoropropyl)thio]benzoate, with the CAS number 88489-61-6, is an organofluorine compound characterized by the presence of both a methyl ester and a thioether functional group. This compound features a benzoate moiety, which contributes to its aromatic properties, and a heptafluoropropyl group that imparts significant fluorine content, enhancing its chemical stability and hydrophobicity. The presence of fluorine atoms typically results in unique physical properties, such as low surface tension and high thermal stability. The thioether linkage introduces sulfur into the structure, which can influence reactivity and solubility. Methyl 3-[(1,1,2,2,3,3,3-heptafluoropropyl)thio]benzoate may exhibit applications in various fields, including materials science and pharmaceuticals, due to its distinctive chemical characteristics. However, specific safety and handling guidelines should be followed, as with all chemical substances, to mitigate any potential hazards associated with its use.

Formula: C₁₁H₇F₇O₂S

InChI: InChI=1S/C11H7F7O2S/c1-20-8(19)6-3-2-4-7(5-6)21-11(17,18)9(12,13)10(14,15)16/h2-5H,1H3

InChI key: InChIKey=IKRAKKMESSVLBF-UHFFFAOYSA-N

SMILES: S(C(C(C(F)(F)F)(F)F)(F)F)C1=CC(C(OC)=O)=CC=C1

Synonyms:

• Methyl 3-[(1,1,2,2,3,3,3-heptafluoropropyl)thio]benzoate
• Benzoic acid, 3-[(heptafluoropropyl)thio]-, methyl ester
• Benzoic acid, 3-[(1,1,2,2,3,3,3-heptafluoropropyl)thio]-, methyl ester

Benzoic acid, 3-[(heptafluoropropyl)thio]-, methyl ester

CAS: 88489-61-6

Formula: C₁₁H₇F₇O₂S

Molecular weight: 336.2259

Ref: IN-DA004A01