4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID
- CAS NO.:56671-28-4
- Empirical Formula: C9H8O4
- Molecular Weight: 180.16
- MDL number: MFCD00052170
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-05-04 17:34:40
What is 4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID?
Chemical properties
White needle crystals. Melting point 141℃.
The Uses of 4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID
4-Oxo-4,5,6,7-tetrahydrobenzo[b]furan-3-carboxylic acid can be used as an intermediate of Propala.
Definition
ChEBI: 4-oxo-4,5,6,7-tetrahydrobenzo[b]furan-3-carboxylic acid is a member of benzofurans.
Synthesis
The methanol solution of resorcinol and potassium hydroxide is used to react with hydrogen under the action of active nickel to generate potassium 3-ketocyclohex-1-enolate, which is then cyclized with ethyl bromopyruvate under alkaline conditions , and then acidified to obtain ?4-oxo-4,5,6,7-tetrahydrobenzo[b]furan-3-carboxylic acid.
Properties of 4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID
Melting point: | 140 °C |
Boiling point: | 383.5±42.0 °C(Predicted) |
Density | 1.406±0.06 g/cm3(Predicted) |
storage temp. | 2-8°C |
pka | 3.74±0.20(Predicted) |
CAS DataBase Reference | 56671-28-4 |
Safety information for 4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID
Signal word | Danger |
Pictogram(s) |
Corrosion Corrosives GHS05 |
GHS Hazard Statements |
H314:Skin corrosion/irritation H318:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P310:Immediately call a POISON CENTER or doctor/physician. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID
Related products of tetrahydrofuran
2-methyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-3-carboxylic acid
4-OXO-4,5,6,7-TETRAHYDROBENZO[B]FURAN-3-CARBOXYLIC ACID
ETHYL 2,5,5-TRIMETHYL-7-OXO-3,4,5,6-TETRAHYDRO-3-OXAINDENECARBOXYLATE
6,6-DIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1-BENZOFURAN-3-CARBOXYLIC ACID
METHYL 4-OXO-4,5,6,7-TETRAHYDRO-1-BENZOFURAN-3-CARBOXYLATE
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