5-Amino-1-(4-nitrophenyl)-1H-pyrazole-4-carbonitrile structure
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Common Name | 5-Amino-1-(4-nitrophenyl)-1H-pyrazole-4-carbonitrile | ||
|---|---|---|---|---|
| CAS Number | 5394-41-2 | Molecular Weight | 229.19500 | |
| Density | 1.51g/cm3 | Boiling Point | 492.3ºC at 760mmHg | |
| Molecular Formula | C10H7N5O2 | Melting Point | 191-193ºC | |
| MSDS | N/A | Flash Point | 251.5ºC | |
| Name | 5-amino-1-(4-nitrophenyl)pyrazole-4-carbonitrile |
|---|---|
| Synonym | More Synonyms |
| Density | 1.51g/cm3 |
|---|---|
| Boiling Point | 492.3ºC at 760mmHg |
| Melting Point | 191-193ºC |
| Molecular Formula | C10H7N5O2 |
| Molecular Weight | 229.19500 |
| Flash Point | 251.5ºC |
| Exact Mass | 229.06000 |
| PSA | 113.45000 |
| LogP | 2.33878 |
| Index of Refraction | 1.725 |
| InChIKey | OAPYCPXMCXWPHI-UHFFFAOYSA-N |
| SMILES | N#Cc1cnn(-c2ccc([N+](=O)[O-])cc2)c1N |
| Hazard Codes | Xi |
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| HS Code | 2933199090 |
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5-Amino-1-(4-ni... CAS#:5394-41-2 |
| Literature: BAYER PHARMA AKTIENGESELLSCHAFT; HEISLER, Iring; MÜLLER, Thomas; GOLZ, Stefan; TELSER, Joachim; REHWINKEL, Hartmut; SIEBENEICHER, Holger; BUCHMANN, Bernd; ZORN, Ludwig; EIS, Knut; KOPPITZ, Marcus; LINDNER, Niels; HÉROULT, Mélanie; NEUHAUS, Roland Patent: WO2013/182612 A1, 2013 ; Location in patent: Page/Page column 146 ; |
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~70%
5-Amino-1-(4-ni... CAS#:5394-41-2 |
| Literature: Dos Santos, Mauricio S.; Gomes, Adriana O.; Bernardino, Alice M. R.; De Souza, Marcos C.; Khan, Misbahul A.; De Brito, Monique A.; Castro, Helena C.; Abreu, Paula A.; Rodrigues, Carlos R.; De Leo, Rosa M. M.; Leon, Leonor L.; Canto-Cavalheirr, Marilene M. Journal of the Brazilian Chemical Society, 2011 , vol. 22, # 2 p. 352 - 358 |
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5-Amino-1-(4-ni... CAS#:5394-41-2 |
| Literature: Journal of Medicinal Chemistry, , vol. 34, # 9 p. 2892 - 2898 |
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5-Amino-1-(4-ni... CAS#:5394-41-2 |
| Literature: Journal of Medicinal Chemistry, , vol. 34, # 9 p. 2892 - 2898 |
| HS Code | 2933199090 |
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| Summary | 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
| MFCD00052885 |