[3-(4-Fluorophenyl)isoxazol-5-yl]methanol structure
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Common Name | [3-(4-Fluorophenyl)isoxazol-5-yl]methanol | ||
|---|---|---|---|---|
| CAS Number | 206055-89-2 | Molecular Weight | 193.17400 | |
| Density | 1.299g/cm3 | Boiling Point | 358.46ºC at 760 mmHg | |
| Molecular Formula | C10H8FNO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 170.591ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.299g/cm3 |
|---|---|
| Boiling Point | 358.46ºC at 760 mmHg |
| Molecular Formula | C10H8FNO2 |
| Molecular Weight | 193.17400 |
| Flash Point | 170.591ºC |
| Exact Mass | 193.05400 |
| PSA | 46.26000 |
| LogP | 1.97300 |
| Vapour Pressure | 0mmHg at 25°C |
| Index of Refraction | 1.554 |
| InChIKey | AXHZYGAOISWOLE-UHFFFAOYSA-N |
| SMILES | OCc1cc(-c2ccc(F)cc2)no1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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[3-(4-Fluorophe... CAS#:206055-89-2 |
| Literature: Bulletin of the Korean Chemical Society, , vol. 33, # 12 p. 4227 - 4230 |
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~81%
[3-(4-Fluorophe... CAS#:206055-89-2 |
| Literature: Wang, Xi-Zhao; Jia, Jiong; Zhang, Yan; Xu, Wei-Ren; Liu, Wei; Shi, Fang-Niu; Wang, Jian-Wu Journal of the Chinese Chemical Society, 2007 , vol. 54, # 3 p. 643 - 652 |
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[3-(4-Fluorophe... CAS#:206055-89-2 |
| Literature: US2003/176447 A1, ; |
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[3-(4-Fluorophe... CAS#:206055-89-2 |
| Literature: Synthesis, , # 12 p. 1663 - 1668 |
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[3-(4-Fluorophe... CAS#:206055-89-2 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 21, # 15 p. 4652 - 4657 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 0 | |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Growth inhibition of Leishmania amazonensis MHOM/BR/77/LTB0016 amastigote forms expre...
Source: ChEMBL
Target: Leishmania amazonensis
External Id: CHEMBL3999365
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|
Name: Trypanocidal activity against Trypanosoma cruzi Tulahuen trypomastigote forms at 3.9 ...
Source: ChEMBL
Target: Trypanosoma cruzi
External Id: CHEMBL3999364
|
|
Name: Cytotoxicity against human THP1 cells assessed as reduction in cell viability after 7...
Source: ChEMBL
Target: THP-1
External Id: CHEMBL3999359
|
|
Name: Trypanocidal activity against Trypanosoma cruzi Tulahuen amastigote forms infected in...
Source: ChEMBL
Target: Trypanosoma cruzi
External Id: CHEMBL3999358
|
|
Name: Growth inhibition of Trypanosoma cruzi Tulahuen amastigote forms infected in human TH...
Source: ChEMBL
Target: Trypanosoma cruzi
External Id: CHEMBL3999356
|
|
Name: Antileishmanial activity against Leishmania amazonensis MHOM/BR/77/LTB0016 amastigote...
Source: ChEMBL
Target: Leishmania amazonensis
External Id: CHEMBL3999367
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| (3-(4-Fluorophenyl)isoxazol-5-yl)methanol |
| [3-(4-fluorophenyl)isoxazol-5-yl]methan-1-ol |
| 3-(4-fluorophenyl)-5-hydroxymethylisoxazole |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol have? |
| A: English synonyms of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol: (3-(4-Fluorophenyl)isoxazol-5-yl)methanol, [3-(4-fluorophenyl)isoxazol-5-yl]methan-1-ol, 3-(4-fluorophenyl)-5-hydroxymethylisoxazole. |
| Q: What is the molecular formula of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: Molecular formula of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is C10H8FNO2. |
| Q: What are the upstream materials of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: Related upstream materials(CAS) of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol: 459-23-4;107-19-7;42202-95-9;459-57-4. |
| Q: What is the English name of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: The English name of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol. |
| Q: What is the boiling point of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: Boiling point of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is 358.46ºC at 760 mmHg. |
| Q: What is the SMILES notation of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: SMILES notation of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is OCc1cc(-c2ccc(F)cc2)no1. |
| Q: What is the LogP of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: LogP of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is 1.97300. |
| Q: What is the polar surface area (PSA) of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: Polar surface area (PSA) of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is 46.26000. |
| Q: What is the InChIKey of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: InChIKey of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is AXHZYGAOISWOLE-UHFFFAOYSA-N. |
| Q: What is the molecular weight of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol? |
| A: Molecular weight of [3-(4-fluorophenyl)-1,2-oxazol-5-yl]methanol is 193.17400. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |