3'-Methylacetanilide
- Product Name3'-Methylacetanilide
- CAS537-92-8
- MFC9H11NO
- MW149.19
- EINECS208-678-1
- MOL File537-92-8.mol
Chemical Properties
| Melting point | 65-67 °C (lit.) |
| Boiling point | 303 °C (lit.) |
| Density | 1.1410 |
| vapor pressure | 16 mm Hg ( 163 °C) |
| refractive index | 1.5279 (estimate) |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | alcohol: freely soluble(lit.) |
| pka | 15.12±0.70(Predicted) |
| form | powder to crystal |
| color | White to Light gray to Light yellow |
| Merck | 14,74 |
| Stability | Stable. Incompatible with strong oxidizing agents. |
| InChI | 1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11) |
| InChIKey | ALMHSXDYCFOZQD-UHFFFAOYSA-N |
| SMILES | CC(=O)Nc1cccc(C)c1 |
| CAS DataBase Reference | 537-92-8(CAS DataBase Reference) |
| NIST Chemistry Reference | N-(3-Tolyl)acetic acid amide(537-92-8) |
| EPA Substance Registry System | m-Acetotoluidide (537-92-8) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| RTECS | AN2875000 |
| TSCA | TSCA listed |
| HS Code | 29242998 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Toxicity | LD50 orl-mus: 1450 mg/kg TXAPA9 19,20,71 |
