2-Phenylisobutyric acid
- Product Name2-Phenylisobutyric acid
- CAS826-55-1
- CBNumberCB8424536
- MFC10H12O2
- MW164.2
- EINECS212-556-3
- MDL NumberMFCD00014332
- MOL File826-55-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 80-82°C |
| Boiling point | 146.5°C |
| Density | 1.089±0.06 g/cm3(Predicted) |
| Flash point | 146.5°C |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| pka | 4.39±0.10(Predicted) |
| form | Crystalline |
| color | White |
| Water Solubility | Insoluble in water. |
| InChI | InChI=1S/C10H12O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12) |
| InChIKey | YYEROYLAYAVZNW-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC=C1)C(C)(C)C(=O)O |
| LogP | 2.3 at 20℃ |
| CAS DataBase Reference | 826-55-1(CAS DataBase Reference) |
| FDA UNII | DR8HUH2GYK |
| UNSPSC Code | 12352106 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319 | |||||||||
| Precautionary statements | P264-P280a-P305+P351+P338-P321-P332+P313-P337+P313 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38-36/38 | |||||||||
| Safety Statements | 26-36/37/39 | |||||||||
| WGK Germany | WGK 1 | |||||||||
| HS Code | 2916399090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| NFPA 704: |
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