901001

4-Methoxycarbonylcubanecarboxylic acid

≥97%

• Synonym(s): (1s,2R,3R,4s,5s,6S,7S,8r)-4-(Methoxycarbonyl)cubane-1-carboxylic acid, Pentacyclo[4.2.0.02,5.03,8.04,7]octane-1,4-dicarboxylic acid, 1-methyl ester
• Empirical Formula (Hill Notation): C₁₁H₁₀O₄
• CAS Number: 24539-28-4
• Molecular Weight: 206.19
• MDL number: MFCD21091123
• UNSPSC Code: 12352106
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: ≥97%
• form: powder or crystals
• mp: 181 °C
• functional group: carboxylic acid; ester
• SMILES string: OC([C@]12[C@H]3[C@H]4[C@@H]1[C@H]5[C@@]4(C(OC)=O)[C@H]3[C@@H]52)=O
• InChI: 1S/C11H10O4/c1-15-9(14)11-5-2-6(11)4-7(11)3(5)10(2,4)8(12)13/h2-7H,1H3,(H,12,13)
• InChI key: ARRJEFLYRAVFJA-UHFFFAOYSA-N

Description

Application

4-Methoxycarbonylcubanecarboxylic acid is a tertiary carboxylic acid that can undergo iododecarboxylation using 1,3-diiodo-5,5-dimethylhydantoin (DIH) as both reaction initiator and iodine source under irradiative conditions. This product was previously listed as BML00136.

Other Notes

Metal-Free Efficient, General and Facile Iododecarboxylation Method with Biodegradable Co-Products

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable