Methyl 2-iodobenzoate
ALDRICH/532851 - 97%
Synonym: Methyl o-iodobenzoate
CAS Number: 610-97-9
Empirical Formula (Hill Notation): C8H7IO2
Molecular Weight: 262.04
EC Number: 210-243-6
MDL Number: MFCD00016351
Linear Formula: IC6H4CO2CH3
Product Type: Chemical
| assay | 97% |
| bp | 149-150 °C/10 mmHg (lit.) |
| density | 1.784 g/mL at 25 °C (lit.) |
| functional group | ester |
| iodo | |
| InChI | 1S/C8H7IO2/c1-11-8(10)6-4 |
| InChI key | BXXLTVBTDZXPTN-UHFFFAOYSA |
| Quality Level | 200  |
| refractive index | n |
| SMILES string | COC(=O)c1ccccc1I |
| Application: | Methyl 2-iodobenzoate may be used in the preparation of: • N-substituted 4-methylene-3,4-dihydro-1 • methyl diphenylacetylene-2-carbo • 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) |
| General description: | 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. |
| Packaging: | 50, 250 g in glass bottle |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | Not applicable |
| Flash Point(C) | Not applicable |
| Purity | 97% |
| bp | 149-150 °C/10 mmHg (lit.) |
| Density | 1.784 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |