4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid
- CAS NO.：71675-87-1
- Empirical Formula: C10H13NO5S
- Molecular Weight: 259.28
- MDL number: MFCD04973619
- EINECS: 275-833-8
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-11-21 15:02:05
What is 4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid?
Chemical properties
Slightly Pink Solid
The Uses of 4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid
4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid is used as an impurity found in amisulpride (A633250). Amisulpride EP Impurity E.
Flammability and Explosibility
Not classified
Reactions
4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid reacts with aluminium to produce an acylation reaction that produces 2,2'-dithiodiethanol (DTE). The DTE can be reacted with an organic compound to produce a variety of products, including salicylic acid or bromoethanes.
Preparation
2-Methoxy-4-amino-5-ethylsulfonyl benzoic acid can be produced by the reaction of hydrochloric acid with thionyl chloride.
Properties of 4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid
| Melting point: | 82-85°C |
| Boiling point: | 529.6±50.0 °C(Predicted) |
| Density | 1.390±0.06 g/cm3(Predicted) |
| vapor pressure | 0Pa at 25℃ |
| storage temp. | Keep in dark place,Inert atmosphere,2-8°C |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 4.09±0.10(Predicted) |
| color | White to buff coloured powder |
| Water Solubility | 8.555g/L at 25℃ |
| InChI | InChI=1S/C10H13NO5S/c1-3-17(14,15)9-4-6(10(12)13)8(16-2)5-7(9)11/h4-5H,3,11H2,1-2H3,(H,12,13) |
| CAS DataBase Reference | 71675-87-1(CAS DataBase Reference) |
Safety information for 4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid
Computed Descriptors for 4-Amino-5-ethylsulfonyl-2-methoxybenzoic acid
| InChIKey | OJVNCXHGGYYOPH-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC(S(CC)(=O)=O)=C(N)C=C1OC |
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