PATULIN
- Product NamePATULIN
- CAS149-29-1
- CBNumberCB5780754
- MFC7H6O4
- MW154.12
- EINECS205-735-2
- MDL NumberMFCD00005858
- MOL File149-29-1.mol
Chemical Properties
| Melting point | 108-111 °C |
| alpha | D21 -6.2° (chloroform) |
| Boiling point | 197.46°C (rough estimate) |
| Density | 1.1993 (rough estimate) |
| refractive index | 1.4300 (estimate) |
| Flash point | 2℃ |
| storage temp. | −20°C |
| solubility | ethyl acetate: soluble50mg/mL |
| pka | 11.69±0.20(Predicted) |
| form | Crystals or Crystalline Powder |
| color | White |
| Merck | 13,7125 |
| BRN | 149675 |
| Stability | Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20°C for up to 1 month. |
| Major Application | cleaning products cosmetics food and beverages personal care |
| InChI | 1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2 |
| InChIKey | ZRWPUFFVAOMMNM-UHFFFAOYSA-N |
| SMILES | OC1OCC=C2OC(=O)C=C12 |
Safety
| Symbol(GHS) |
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| Signal word | Danger | |||||||||
| Hazard statements | H300-H315 | |||||||||
| Precautionary statements | P264-P270-P280-P301+P310-P302+P352-P332+P313 | |||||||||
| Hazard Codes | T,Xn,C,F | |||||||||
| Risk Statements | 25-38-48/20/22-40-22-34-11-36-20/21/22-67-36/38-20-63 | |||||||||
| Safety Statements | 45-36/37-36/37/39-26-16 | |||||||||
| RIDADR | UN 3462 6.1/PG 2 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | LV2625000 | |||||||||
| HazardClass | 6.1(a) | |||||||||
| PackingGroup | I | |||||||||
| HS Code | 29419090 | |||||||||
| Storage Class | 3 - Flammable liquids | |||||||||
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Flam. Liq. 2 | |||||||||
| Hazardous Substances Data | 149-29-1(Hazardous Substances Data) | |||||||||
| Toxicity | LD50 s.c. in mice: 10-15 mg/kg (Kinosita, Shikata) | |||||||||
| NFPA 704: |
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