4-Isopropoxybenzoic acid
- Product Name4-Isopropoxybenzoic acid
- CAS13205-46-4
- CBNumberCB8156547
- MFC10H12O3
- MW180.2
- EINECS236-169-4
- MDL NumberMFCD00044318
- MOL File13205-46-4.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 164-167 °C (lit.) |
| Boiling point | 297℃ |
| Density | 1.130 |
| refractive index | 1.5160 (estimate) |
| Flash point | 116℃ |
| storage temp. | Store below +30°C. |
| pka | pK1:4.68 (20°C) |
| form | powder to crystal |
| color | White to Almost white |
| Water Solubility | Insoluble in water. |
| InChI | 1S/C10H12O3/c1-7(2)13-9-5-3-8(4-6-9)10(11)12/h3-7H,1-2H3,(H,11,12) |
| InChIKey | ZVERWTXKKWSSHH-UHFFFAOYSA-N |
| SMILES | CC(C)Oc1ccc(cc1)C(O)=O |
| CAS DataBase Reference | 13205-46-4(CAS DataBase Reference) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H335-H315-H319 | |||||||||
| Precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 24/25 | |||||||||
| WGK Germany | 3 | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29189900 | |||||||||
| Storage Class | 13 - Non Combustible Solids | |||||||||
| NFPA 704: |
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