1,4-Phenylenediacetic acid
- Product Name1,4-Phenylenediacetic acid
- CAS7325-46-4
- CBNumberCB1663893
- MFC10H10O4
- MW194.18
- EINECS230-801-2
- MDL NumberMFCD00004354
- MOL File7325-46-4.mol
Chemical Properties
| Melting point: | 248-252 °C (lit.) |
| Boiling point: | 290.62°C (rough estimate) |
| Density | 1.2534 (rough estimate) |
| refractive index | 1.5430 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMF: 5 mg/ml; Ethanol: 30 mg/ml |
| form | Powder |
| pka | 4.03±0.10(Predicted) |
| color | Light yellow to beige |
| Water Solubility | Slightly soluble in water. |
| BRN | 1960342 |
| InChI | 1S/C10H10O4/c11-9(12)5-7-1-2-8(4-3-7)6-10(13)14/h1-4H,5-6H2,(H,11,12)(H,13,14) |
| InChIKey | SLWIPPZWFZGHEU-UHFFFAOYSA-N |
| SMILES | OC(=O)Cc1ccc(CC(O)=O)cc1 |
| CAS DataBase Reference | 7325-46-4(CAS DataBase Reference) |
| NIST Chemistry Reference | 1,4-Phenylenediacetic acid(7325-46-4) |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Gloves | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-36-37/39 | |||||||||
| WGK Germany | 3 | |||||||||
| TSCA | T | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 2917399090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications |
Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
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| NFPA 704: |
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