![3-[o-(alpha,alpha,alpha-trifluorotolyl)]propionic acid Structure](https://www.chemicalbook.com/CAS/GIF/94022-99-8.gif)
3-[o-(alpha,alpha,alpha-trifluorotolyl)]propionic acid
- Product Name3-[o-(alpha,alpha,alpha-trifluorotolyl)]propionic acid
- CAS94022-99-8
- CBNumberCB5879359
- MFC10H9F3O2
- MW218.17
- EINECS301-594-7
- MDL NumberMFCD06823965
- MOL File94022-99-8.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 84-88 °C |
| Boiling point | 266.9±35.0 °C(Predicted) |
| Density | 1.307±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 4.53±0.10(Predicted) |
| color | White |
| InChI | InChI=1S/C10H9F3O2/c11-10(12,13)8-4-2-1-3-7(8)5-6-9(14)15/h1-4H,5-6H2,(H,14,15) |
| InChIKey | YTDVNFDGHHHPEE-UHFFFAOYSA-N |
| SMILES | C1(CCC(O)=O)=CC=CC=C1C(F)(F)F |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H315-H319-H335 | |||||||||
| Precautionary statements | P261-P264-P270-P301+P312-P302+P352-P305+P351+P338 | |||||||||
| Hazard Codes | Xn | |||||||||
| Risk Statements | 22-36/37/38 | |||||||||
| Safety Statements | 26-36/37 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Harmful | |||||||||
| TSCA | Yes | |||||||||
| HS Code | 29163990 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 | |||||||||
| NFPA 704: |
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