Introduction：Basic information about CAS 112809-52-6|Letrozole related compound B, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Letrozole related compound B |
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| CAS Number | 112809-52-6 | Molecular Weight | 285.30300 |
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| Density | 1.21g/cm3 | Boiling Point | 563.5ºC at 760mmHg |
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| Molecular Formula | C17H11N5 | Melting Point | / |
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| MSDS | / | Flash Point | 294.6ºC |
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Names
| Name | 4-[(4-cyanophenyl)-(1,2,4-triazol-4-yl)methyl]benzonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.21g/cm3 |
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| Boiling Point | 563.5ºC at 760mmHg |
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| Molecular Formula | C17H11N5 |
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| Molecular Weight | 285.30300 |
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| Flash Point | 294.6ºC |
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| Exact Mass | 285.10100 |
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| PSA | 78.29000 |
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| LogP | 2.65916 |
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| Vapour Pressure | 1.01E-12mmHg at 25°C |
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| Index of Refraction | 1.665 |
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| InChIKey | BCTXUGAAOFIJGX-UHFFFAOYSA-N |
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| SMILES | N#Cc1ccc(C(c2ccc(C#N)cc2)n2cnnc2)cc1 |
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Safety Information
| RIDADR | NONH for all modes of transport |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| letrozole regioisomer |
| Iso Letrozole |
| UNII-7VSW8QP34K |
| Letrozole Impurity 1 |
