Introduction：Basic information about CAS 39562-17-9|Methyl 2-(3-nitrobenzylidene)-3-oxobutyrate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Methyl 2-(3-nitrobenzylidene)-3-oxobutyrate |
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| CAS Number | 39562-17-9 | Molecular Weight | 249.219 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 387.5±32.0 °C at 760 mmHg |
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| Molecular Formula | C12H11NO5 | Melting Point | 158ºC |
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| MSDS | / | Flash Point | 171.8±27.1 °C |
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Names
| Name | Methyl 3-nitrobenzylideneacetoacetate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 387.5±32.0 °C at 760 mmHg |
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| Melting Point | 158ºC |
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| Molecular Formula | C12H11NO5 |
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| Molecular Weight | 249.219 |
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| Flash Point | 171.8±27.1 °C |
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| Exact Mass | 249.063721 |
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| PSA | 89.19000 |
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| LogP | 1.58 |
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| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
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| Index of Refraction | 1.583 |
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| InChIKey | LYUBYLJQOZIBQB-UHFFFAOYSA-N |
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| SMILES | COC(=O)C(=Cc1cccc([N+](=O)[O-])c1)C(C)=O |
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Safety Information
| Hazard Codes | Xi,N |
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| Risk Phrases | 43-50/53 |
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| Safety Phrases | 24-37-60-61 |
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| HS Code | 2918300090 |
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Customs
| HS Code | 2918300090 |
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| Summary | 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
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Synonyms
| Methyl 2-(3-nitrobenzylidene)-3-oxobutanoate |
| Methyl 2-(3-nitrobenzylidene)-3-oxobutyrate |
| 3-Nitrobenzylidenacetessigsaeuremethylester |
| ETHYL 3-NITROBENZYLIDENACETOACETATE |
| EINECS 405-270-7 |
| WNR C1UYV1&VO1 |
| Butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo-, methyl ester |
| MFCD00142134 |
