Mono-methyl isophthalate
- Product NameMono-methyl isophthalate
- CAS1877-71-0
- CBNumberCB3387692
- MFC9H8O4
- MW180.16
- MDL NumberMFCD00029972
- MOL File1877-71-0.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 194-196 °C (lit.) |
| Boiling point | 339.3±25.0 °C(Predicted) |
| Density | 1.288±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMSO (Slightly), Methanol (Slightly), Water (Slightly) |
| form | Crystalline Powder |
| pka | 3.83±0.10(Predicted) |
| color | White to off-white |
| BRN | 2048750 |
| InChI | InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11) |
| InChIKey | WMZNGTSLFSJHMZ-UHFFFAOYSA-N |
| SMILES | C1(C(OC)=O)=CC=CC(C(O)=O)=C1 |
| CAS DataBase Reference | 1877-71-0(CAS DataBase Reference) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-36 | |||||||||
| WGK Germany | 3 | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29163990 | |||||||||
| Storage Class | 13 - Non Combustible Solids | |||||||||
| NFPA 704: |
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