3-ACETYLBENZOIC ACID
- Product Name3-ACETYLBENZOIC ACID
- CAS586-42-5
- MFC9H8O3
- MW164.16
- EINECS
- MOL File586-42-5.mol
Chemical Properties
| Melting point | 163-171 °C |
| Boiling point | 251.61°C (rough estimate) |
| Density | 1.2132 (rough estimate) |
| refractive index | 1.5380 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | soluble in Methanol |
| form | Crystalline Powder |
| pka | pK1: 3.83 (25°C) |
| color | White to light brown |
| InChI | InChI=1S/C9H8O3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3,(H,11,12) |
| InChIKey | CHZPJUSFUDUEMZ-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC=CC(C(C)=O)=C1 |
| CAS DataBase Reference | 586-42-5(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 37/39-26-36-24/25 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 29183000 |
| Storage Class | 11 - Combustible Solids |
