2-Fluoro-6-(4-methylphenoxy)benzonitrile
2-Fluoro-6-(4-methylphenoxy)benzonitrile structure
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Common Name | 2-Fluoro-6-(4-methylphenoxy)benzonitrile | ||
|---|---|---|---|---|
| CAS Number | 175204-08-7 | Molecular Weight | 227.23400 | |
| Density | 1.21g/cm3 | Boiling Point | 323ºC at 760mmHg | |
| Molecular Formula | C14H10FNO | Melting Point | 93-95ºC | |
| MSDS | N/A | Flash Point | 149.1ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Fluoro-6-(4-methylphenoxy)benzonitrile |
|---|---|
| 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 | 1.21g/cm3 |
|---|---|
| Boiling Point | 323ºC at 760mmHg |
| Melting Point | 93-95ºC |
| Molecular Formula | C14H10FNO |
| Molecular Weight | 227.23400 |
| Flash Point | 149.1ºC |
| Exact Mass | 227.07500 |
| PSA | 33.02000 |
| LogP | 3.79808 |
| Vapour Pressure | 0.00027mmHg at 25°C |
| Index of Refraction | 1.582 |
| InChIKey | JLTWAYPSQIKWIL-UHFFFAOYSA-N |
| SMILES | Cc1ccc(Oc2cccc(F)c2C#N)cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | R20/21/22 |
| Safety Phrases | 26-36/37/39 |
| HS Code | 2926909090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Luciferase/luciferin-expressing antifolate-resistant parasites were used to infect a ...
Source: ChEMBL
Target: HepG2-CD81
External Id: CHEMBL4483864
|
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Name: Luciferase/luciferin-expressing antifolate-resistant parasites were used to infect a ...
Source: ChEMBL
Target: Plasmodium berghei
External Id: CHEMBL4483863
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD00068203 |
| 2-fluoro-6-(4-methylphenoxy)benzonitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: Molecular weight of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 227.23400. |
| Q: What is the LogP of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: LogP of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 3.79808. |
| Q: What is the boiling point of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: Boiling point of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 323ºC at 760mmHg. |
| Q: What is the SMILES notation of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: SMILES notation of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is Cc1ccc(Oc2cccc(F)c2C#N)cc1. |
| Q: What is the English name of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: The English name of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 2-Fluoro-6-(4-methylphenoxy)benzonitrile. |
| Q: What is the safety information for 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: Safety information for 2-Fluoro-6-(4-methylphenoxy)benzonitrile: 26-36/37/39. |
| Q: What is the melting point of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: Melting point of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 93-95ºC. |
| Q: What is the InChIKey of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: InChIKey of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is JLTWAYPSQIKWIL-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: Polar surface area (PSA) of 2-Fluoro-6-(4-methylphenoxy)benzonitrile is 33.02000. |
| Q: What are the upstream materials of 2-Fluoro-6-(4-methylphenoxy)benzonitrile? |
| A: Related upstream materials(CAS) of 2-Fluoro-6-(4-methylphenoxy)benzonitrile: 106-44-5;1897-52-5. |
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. |