HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 968949Generated: October 26, 2026
Barium hydroxide, monohydrate → 3-Hydroxymethyl-5-methyl-2,3-dihydrobenzo[1,4]dioxine-6-carboxylic acid
https://huagongshe.com/reaction/968949
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Barium hydroxide, monohydrate | HCID 17749100 | — |
| Reactant | 3-Hydroxymethyl-5-methyl-2,3-dihydrobenzo[1,4]dioxine-6-carboxylic acid methyl ester | HCID 68778831 | — |
| Solvent | Methanol | HCID 887 | — |
| Product | 3-Hydroxymethyl-5-methyl-2,3-dihydrobenzo[1,4]dioxine-6-carboxylic acid | HCID 68776292 | 80% |
Reaction Steps
To a round bottom flask equipped with magnetic stirring was added 3-hydroxymethyl-5-methyl-2,3-dihydrobenzo[1,4]dioxine-6-carboxylic acid methyl ester (6.40 g, 26.9 mmol), barium hydroxide monohydrate (25.44 g, 134.3 mmol), and methanol (108 mL). This mixture was stirred at room temperature for 24 hours. The methanol was evaporated. The resulting slurry was taken up in water and washed once with ether. The aqueous layer was acidified by pouring into iced concentrated HCl. This was extracted twice with ethyl acetate. The ethyl acetate extracts were combined, dried over magnesium sulfate, filtered and evaporated to give a yellow solid, 3-hydroxymethyl-5-methyl-2,3-dihydrobenzo[1,4]dioxine-6-carboxylic acid, (4.82 g, 21.5 mmol) in 80% yield. 1H-NMR (300 MHz, CD3COCD3) δ (ppm): 2.45 (s, 3H), 3.85 (m, 2H), 4.12 (m, 1H), 4.24 (m, 1H), 4.41 (m, 1H), 6.76 (d, 1H), 7.51 (d, 1H); TLC: Rf=0.32 (1:1 ethyl acetate/hexane).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US07304161B2 |
|---|
| Source dataset | uspto-grants-2007_12 |
|---|
| ORD ID | ord-36162aa89b4f40cab860aafde25d1acb |
|---|
| Source note | uspto-grants-2007_12 |
|---|