3-(4-Nitrophenyl)propanoic acid
- Product Name3-(4-Nitrophenyl)propanoic acid
- CAS16642-79-8
- CBNumberCB2708568
- MFC9H9NO4
- MW195.17
- EINECS672-244-1
- MDL NumberMFCD00126834
- MOL File16642-79-8.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 167-170°C |
| Boiling point | 331.83°C (rough estimate) |
| Density | 1.3544 (rough estimate) |
| refractive index | 1.5700 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| pka | 4.47(at 25℃) |
| form | solid |
| color | yellow |
| Water Solubility | Slightly soluble in water. |
| InChI | InChI=1S/C9H9NO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5H,3,6H2,(H,11,12) |
| InChIKey | VZOPVJNBOQOLPN-UHFFFAOYSA-N |
| SMILES | C1(CCC(O)=O)=CC=C([N+]([O-])=O)C=C1 |
| CAS DataBase Reference | 16642-79-8(CAS DataBase Reference) |
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 | Xn | |||||||||
| Risk Statements | 22-36/37/38-20/21/22 | |||||||||
| Safety Statements | 26-36/37/39 | |||||||||
| Hazard Note | Harmful | |||||||||
| HS Code | 29163990 | |||||||||
| NFPA 704: |
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