2-(2,5-Dimethyl-pyrrol-1-yl)-3-phenyl-propionic acid
- Product Name2-(2,5-Dimethyl-pyrrol-1-yl)-3-phenyl-propionic acid
- CAS130016-75-0
- CBNumberCB7230349
- MFC15H17NO2
- MW243.3
- MDL NumberMFCD02302095
- MOL FileMol file
Chemical Properties
| Boiling point | 409.8±45.0 °C(Predicted) |
| Density | 1.10±0.1 g/cm3(Predicted) |
| pka | 2.59±0.10(Predicted) |
| form | solid |
| InChI | 1S/C15H17NO2/c1-11-8-9-12(2)16(11)14(15(17)18)10-13-6-4-3-5-7-13/h3-9,14H,10H2,1-2H3,(H,17,18) |
| InChIKey | CIUPYBFUPLMRLH-UHFFFAOYSA-N |
| SMILES | Cc1ccc(C)n1C(Cc2ccccc2)C(O)=O |
| UNSPSC Code | 12352106 |
| NACRES | NA.21 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H319-H315-H335 |
| Precautionary statements | P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P |
| Hazard Codes | Xi,Xn |
| Risk Statements | 22 |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral |