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| CAS No.: | 499-04-7 |
|---|---|
| Name: | ARECAIDINE BUT-2-YNYL ESTER TOSYLATE |
| Article Data: | 18 |
| Molecular Structure: | |
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|
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| Formula: | C7H11NO2 |
| Molecular Weight: | 141.17 |
| Synonyms: | 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid;3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-; |
| Density: | 1.166g/cm3 |
| Melting Point: | 232oC (dec.) |
| Boiling Point: | 266.7oC at 760 mmHg |
| Flash Point: | 115.1oC |
| Safety: | Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. |
| PSA: | 40.54000 |
| LogP: | 0.27080 |
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| Conditions | Yield |
|---|---|
| Stage #1: arecoline hydrobromide With sodium carbonate In water pH=10 - 11; Stage #2: With water Reflux; | 89% |
| With barium dihydroxide at 40℃; for 0.5h; | |
| Multi-step reaction with 2 steps 1: aq. Na2CO3 / pH 10 - 11 2: 8.2 g / water / 24 h / Heating View Scheme | |
| With hydrogenchloride; water Heating / reflux; |
- 5657-66-9
3-cyano-1-methyl-1,2,5,6-tetrahydropyridine
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
| Conditions | Yield |
|---|---|
| With hydrogenchloride Erwaermen des Rueckstands mit Barytwasser; |
| Conditions | Yield |
|---|---|
| With hydrogen bromide | |
| With water for 24h; Hydrolysis; Heating; | 8.2 g |
- 63-75-2
arecoline
A
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
B
- 5809-87-0
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxamide
| Conditions | Yield |
|---|---|
| With ammonium hydroxide |
- 13221-89-1, 56026-45-0
1-methyl-4-oxo-piperidine-3-carboxylic acid methyl ester
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
| Conditions | Yield |
|---|---|
| With aluminum nickel; ethanol Hydrogenation.Behandeln des Reaktionsprodukts mit HCl in Essigsaeure; |
- 37673-66-8
4-hydroxy-1-methyl-piperidine-3-carboxylic acid ethyl ester
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
| Conditions | Yield |
|---|---|
| With hydrogenchloride |
- 6138-42-7
3-Carboxy-1-methylpyridiniumiodid
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
| Conditions | Yield |
|---|---|
| With potassium borohydride; alkaline aqueous solution |
| Conditions | Yield |
|---|---|
| With sulfuric acid Electrolysis; |
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
| Conditions | Yield |
|---|---|
| With hydrogenchloride; potassium iodide | |
| With hydrogen bromide |
- 499-04-7
1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
| Conditions | Yield |
|---|---|
| With sodium hydroxide |
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Chemistry
IUPAC name: 1-Methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid
Molecular Formula: C7H11NO2
Molecular Weight: 141.167740 g/mol
Index of Refraction: 1.524
Surface Tension: 44.7 dyne/cm
Density: 1.166 g/cm3
Flash Point: 115.1 °C
Melting point: 232°C (dec.)
Appearance: Crystalline Solid
Enthalpy of Vaporization: 55.56 kJ/mol
Boiling Point: 266.7 °C at 760 mmHg
Vapour Pressure: 0.00245 mmHg at 25 °C
Product Categories: Various Metabolites and Impurities;Intermediates & Fine Chemicals;Metabolites & Impurities;Neurochemicals;Pharmaceuticals;Acetylcholine receptor
Following is the structure of Arecaidine (CAS NO.499-04-7):
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Uses
Arecaidine (CAS NO.499-04-7) can be used as a metabolite of Arecoline, a cholinergic agonist.
Toxicity Data With Reference
| 1. | sce-mus-ipr 1 g/kg/5 D-I | CALEDQ Cancer Letters (Shannon, Ireland). 23 (1984),189. | ||
| 2. | otr-ham:kdy 2500 µg/L | LANCAO Lancet. 1 (1979),112. | ||
| 3. | msc-ham:lng 10 mg/L | CRNGDP Carcinogenesis. 5 (1984),501. |
Safety Profile
Mutation data reported. When heated to decomposition, Arecaidine (CAS NO.499-04-7) emits toxic fumes of NOx.
Specification
Arecaidine , its cas register number is 499-04-7. It also can be called 1,2,5,6-Tetrahydro-1-methyl-3-pyridinecarboxylic acid ; Arecaine ; Methylguvacine ; and N-Methylguvacine . And its classification code is Mutation data.