Introduction：Basic information about CAS 53734-75-1|Neorauflavene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Neorauflavene |
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| CAS Number | 53734-75-1 | Molecular Weight | 352.380 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 568.2±50.0 °C at 760 mmHg |
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| Molecular Formula | C21H20O5 | Melting Point | / |
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| MSDS | / | Flash Point | 297.4±30.1 °C |
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Names
| Name | 5,6,7,8-Tetrahydro-4H-[1,2]oxazolo[4,5-d]azepin-3-ol |
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| Synonym | More Synonyms |
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Neorauflavene BiologicalActivity
| Description | Neorauflavene is a phenolic neorautanenia isoflavanoid isolated from Neorautanenia edulis. Neorauflavene shows antibacterial activities against E. faecalis, S. suis, S. agalactiae, P. aeruginosa, B. subtilis, and R. anatipestifer[1][2]. |
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| Related Catalog | Research Areas >>InfectionSignaling Pathways >>Anti-infection >>Bacterial |
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| References | [1]. A.J.Brink, et al. Phenolic neorautanenia isoflavanoids: The isolation and structures of neorauflavene, (−)-neorauflavane and neoraufurane, three novel isoflavanoids from Neorautanenia edulis. Tetrahedron, Volume 30, Issue 2, 1974, Pages 311-314. [2]. Yang-Guo Xie, et al. Chemical Constituents From Campylotropis Hirtella. Planta Med. 2016 May;82(8):734-41. |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 568.2±50.0 °C at 760 mmHg |
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| Molecular Formula | C21H20O5 |
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| Molecular Weight | 352.380 |
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| Flash Point | 297.4±30.1 °C |
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| Exact Mass | 352.131073 |
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| PSA | 68.15000 |
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| LogP | 5.70 |
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| Vapour Pressure | 0.0±1.6 mmHg at 25°C |
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| Index of Refraction | 1.630 |
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| InChIKey | LDZFETFUTCHVSH-UHFFFAOYSA-N |
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| SMILES | COc1c2c(cc3c1C=CC(C)(C)O3)OCC(c1ccc(O)cc1O)=C2 |
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2932999099 |
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Customs
| HS Code | 2932999099 |
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| Summary | 2932999099. other heterocyclic compounds with oxygen 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
| 4-(5-Methoxy-8,8-dimethyl-2H,8H-pyrano[3,2-g]chromen-3-yl)-1,3-benzenediol |
| 1,3-Benzenediol, 4-(5-methoxy-8,8-dimethyl-2H,8H-benzo[1,2-b:5,4-b']dipyran-3-yl)- |
| Neorauflavene |
