2-FLUORO-6-(4-METHYLPHENYLTHIO)BENZONITRILE
2-FLUORO-6-(4-METHYLPHENYLTHIO)BENZONITRILE structure
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Common Name | 2-FLUORO-6-(4-METHYLPHENYLTHIO)BENZONITRILE | ||
|---|---|---|---|---|
| CAS Number | 175204-11-2 | Molecular Weight | 243.29900 | |
| Density | 1.24g/cm3 | Boiling Point | 363.4ºC at 760 mmHg | |
| Molecular Formula | C14H10FNS | Melting Point | 92-94ºC | |
| MSDS | N/A | Flash Point | 173.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile |
|---|---|
| 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 | 1.24g/cm3 |
|---|---|
| Boiling Point | 363.4ºC at 760 mmHg |
| Melting Point | 92-94ºC |
| Molecular Formula | C14H10FNS |
| Molecular Weight | 243.29900 |
| Flash Point | 173.6ºC |
| Exact Mass | 243.05200 |
| PSA | 49.09000 |
| LogP | 4.15698 |
| Vapour Pressure | 1.8E-05mmHg at 25°C |
| Index of Refraction | 1.623 |
| InChIKey | MDOVOQVAOKWRLK-UHFFFAOYSA-N |
| SMILES | Cc1ccc(Sc2cccc(F)c2C#N)cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| Risk Phrases | R20/21/22 |
| Safety Phrases | S22-S26-S36-S37-S39 |
| HS Code | 2930909090 |
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 | |
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| DownStream 1 | |
CAS#:168910-27-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| hms557c07 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: Polar surface area (PSA) of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is 49.09000. |
| Q: What is the boiling point of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: Boiling point of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is 363.4ºC at 760 mmHg. |
| Q: What is the English name of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: The English name of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile. |
| Q: What is the SMILES notation of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: SMILES notation of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is Cc1ccc(Sc2cccc(F)c2C#N)cc1. |
| Q: What are the downstream products of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: Related downstream products(CAS) of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile: 168910-27-8. |
| Q: What is the molecular formula of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: Molecular formula of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is C14H10FNS. |
| Q: What is the InChIKey of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: InChIKey of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is MDOVOQVAOKWRLK-UHFFFAOYSA-N. |
| Q: What is the CAS number of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: CAS number of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is 175204-11-2. |
| Q: What are the upstream materials of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: Related upstream materials(CAS) of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile: 1897-52-5;106-45-6. |
| Q: What is the molecular weight of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile? |
| A: Molecular weight of 2-fluoro-6-(4-methylphenyl)sulfanylbenzonitrile is 243.29900. |
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. |