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| IUPAC Name: | 6-methoxy-3H-1,3-benzoxazol-2-one |
| Description: | 6-Methoxy-2-benzoxazolinone is an alkaloid isolated from the seed of Coix lacryma-jobi L. var. meyuan (Romen.) Stapf. It acts as a central muscle relaxant with an anti-convulsant effect. |
| Molecular Weight: | 165.15 |
| Molecular Formula: | C8H7NO3 |
| Canonical SMILES: | COC1=CC2=C(C=C1)NC(=O)O2 |
| InChI: | InChI=1S/C8H7NO3/c1-11-5-2-3-6-7(4-5)12-8(10)9-6/h2-4H,1H3,(H,9,10) |
| InChI Key: | MKMCJLMBVKHUMS-UHFFFAOYSA-N |
| Boiling Point: | 292.97°C (rough estimate) |
| Melting Point: | 151-156°C |
| Purity: | ≥95% |
| Density: | 1.309 g/cm3 |
| Solubility: | Soluble in Acetone, Dichloromethane, DMSO, Methanol, Tetrahydrofuran |
| Appearance: | Light Tan Solid |
| Storage: | Store at RT |
| MDL: | MFCD00051726 |
| LogP: | 1.12970 |
| Quality Standard: | Enterprise Standard |
| Refractive Index: | 1.5468 (estimate) |
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