4-Amino-N-methylbenzenemethanesulfonamide
Synonym(s):4-Amino-N-methylbenzenemethanesulfonamide
- CAS NO.：109903-35-7
- Empirical Formula: C8H12N2O2S
- Molecular Weight: 200.26
- MDL number: MFCD00671697
- EINECS: 600-932-3
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-05-27 17:30:58
What is 4-Amino-N-methylbenzenemethanesulfonamide?
The Uses of 4-Amino-N-methylbenzenemethanesulfonamide
4-Amino-N-methylbenzenemethanesulfonamide is an intermediate used in the synthesis of Sumatriptan (S810000).
Properties of 4-Amino-N-methylbenzenemethanesulfonamide
| Melting point: | 140-142 °C(lit.) |
| Boiling point: | 387.6±44.0 °C(Predicted) |
| Density | 1.297±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
| solubility | DMSO (Slightly), Methanol (Slightly, Heated) |
| form | Solid |
| pka | 11.50±0.40(Predicted) |
| color | Pale Yellow to Pale Beige |
| BRN | 5865321 |
| InChI | InChI=1S/C8H12N2O2S/c1-10-13(11,12)6-7-2-4-8(9)5-3-7/h2-5,10H,6,9H2,1H3 |
| CAS DataBase Reference | 109903-35-7(CAS DataBase Reference) |
Safety information for 4-Amino-N-methylbenzenemethanesulfonamide
| Signal word | Danger |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06 |
| GHS Hazard Statements |
H301:Acute toxicity,oral H317:Sensitisation, Skin |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
Computed Descriptors for 4-Amino-N-methylbenzenemethanesulfonamide
| InChIKey | CIWNHTXCBHTWRV-UHFFFAOYSA-N |
| SMILES | C1(CS(NC)(=O)=O)=CC=C(N)C=C1 |
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