ETHYL 4-NITROBENZOYLACETATE
- Product NameETHYL 4-NITROBENZOYLACETATE
- CAS838-57-3
- CBNumberCB8756127
- MFC11H11NO5
- MW237.21
- EINECS212-656-7
- MDL NumberMFCD00007357
- MOL File838-57-3.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 67-71 °C |
| Boiling point | 379.74°C (rough estimate) |
| Density | 1.3350 (rough estimate) |
| refractive index | 1.5300 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| pka | 8.70±0.25(Predicted) |
| form | powder to crystal |
| color | White to Light yellow to Light orange |
| BRN | 1124763 |
| InChI | InChI=1S/C11H11NO5/c1-2-17-11(14)7-10(13)8-3-5-9(6-4-8)12(15)16/h3-6H,2,7H2,1H3 |
| InChIKey | NGRXSVFCLHVGKU-UHFFFAOYSA-N |
| SMILES | C1(C=CC([N+]([O-])=O)=CC=1)C(=O)CC(=O)OCC |
| CAS DataBase Reference | 838-57-3(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | E9KY7LH3TA |
| EPA Substance Registry System | Benzenepropanoic acid, 4-nitro-.beta.-oxo-, ethyl ester (838-57-3) |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H315-H319-H335 | |||||||||
| Precautionary statements | P261-P305+P351+P338 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 24/25-36/37-26 | |||||||||
| WGK Germany | 2 | |||||||||
| RTECS | AJ1073500 | |||||||||
| TSCA | Yes | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29183000 | |||||||||
| NFPA 704: |
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