532851

2-Iodbenzoesäure-methylester

97%

• Synonym(e): Methyl o-iodobenzoate
• Lineare Formel: IC₆H₄CO₂CH₃
• CAS-Nummer: 610-97-9
• Molekulargewicht: 262.04
• EG-Nummer: 210-243-6
• MDL-Nummer: MFCD00016351
• UNSPSC-Code: 12352100
• PubChem Substanz-ID: 24877921
• NACRES: NA.22

Eigenschaften

• Qualitätsniveau: 200
• Assay: 97%
• Brechungsindex: n20/D 1.604 (lit.)
• bp: 149-150 °C/10 mmHg (lit.)
• Dichte: 1.784 g/mL at 25 °C (lit.)
• Funktionelle Gruppe: ester; iodo
• SMILES String: COC(=O)c1ccccc1I
• InChI: 1S/C8H7IO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
• InChIKey: BXXLTVBTDZXPTN-UHFFFAOYSA-N

Beschreibung

Allgemeine Beschreibung

Methyl 2-iodobenzoate can be prepared from 2-iodobenzoic acid via esterification. It undergoes cobalt-catalyzed cyclization with aldehydes to form phthalide derivatives. The microbial dihydroxylation of methyl 2-iodobenzoate forms a nonracemic iodocyclohexene carboxylate intermediate. This intermediate forms the precursor for preparing kibdelone C.

Anwendung

Methyl 2-iodobenzoate may be used in the preparation of:

• N-substituted 4-methylene-3,4-dihydro-1(2H)-isoquinolin-1-ones
• methyl diphenylacetylene-2-carboxylate
• methyl 2-heptynylphenylbenzoate
• (E)-2-[3-[3-[2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-3-oxopropyl]benzoic acid methyl ester
• 4-(2-carbomethoxyphenyl)-3-(1-methylethoxy)cyclobut-3-ene-1,2-dione
• 3-(2-carbomethoxyphenyl)-4-methylcyclobuten-3-ene-1,2-dione 2-(ethylene acetal)

Sicherheitshinweise

• Lagerklassenschlüssel: 10 - Combustible liquids
• WGK: WGK 3
• Flammpunkt (°F): Not applicable
• Flammpunkt (°C): Not applicable
• Persönliche Schutzausrüstung: Eyeshields, Gloves, type ABEK (EN14387) respirator filter