1-(4-Chlorophenyl)-1-cyclopentanecarboxylic acid
- Product Name1-(4-Chlorophenyl)-1-cyclopentanecarboxylic acid
- CAS80789-69-1
- MFC12H13ClO2
- MW224.68
- EINECS279-552-1
- MOL File80789-69-1.mol
Chemical Properties
| Melting point | 162-164 °C (lit.) |
| Boiling point | 364.6±35.0 °C(Predicted) |
| Density | 1.1690 (estimate) |
| storage temp. | 2-8°C |
| solubility | soluble in Methanol |
| pka | 4.26±0.20(Predicted) |
| form | Crystalline Powder or Crystals |
| color | Cream to gray |
| InChI | InChI=1S/C12H13ClO2/c13-10-5-3-9(4-6-10)12(11(14)15)7-1-2-8-12/h3-6H,1-2,7-8H2,(H,14,15) |
| InChIKey | QJNFJEMGWIQMJT-UHFFFAOYSA-N |
| SMILES | C1(C2=CC=C(Cl)C=C2)(C(O)=O)CCCC1 |
Safety Information
| Safety Statements | 24/25 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 29163900 |
| Storage Class | 11 - Combustible Solids |