4-Methyl-3-nitrophenylboronic acid
- Product Name4-Methyl-3-nitrophenylboronic acid
- CAS80500-27-2
- CBNumberCB9700561
- MFC7H8BNO4
- MW180.95
- EINECS672-692-8
- MDL NumberMFCD00191550
- MOL File80500-27-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 265-270 °C (lit.) |
| Boiling point | 356.7±52.0 °C(Predicted) |
| Density | 1.33±0.1 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| solubility | soluble in Methanol,Acetone |
| form | powder to crystal |
| pka | 7.19±0.10(Predicted) |
| color | White to Light yellow to Light orange |
| BRN | 3279018 |
| InChI | 1S/C7H8BNO4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4,10-11H,1H3 |
| InChIKey | OASVXBRTNVFKFS-UHFFFAOYSA-N |
| SMILES | Cc1ccc(cc1[N+]([O-])=O)B(O)O |
| CAS DataBase Reference | 80500-27-2(CAS DataBase Reference) |
| UNSPSC Code | 12352103 |
| 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 | 26-36-37 | |||||||||
| WGK Germany | 3 | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29319090 | |||||||||
| Storage Class | 13 - Non Combustible Solids | |||||||||
| NFPA 704: |
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