6-(4-methoxyphenyl)-6-oxohexanenitrile
6-(4-methoxyphenyl)-6-oxohexanenitrile structure
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Common Name | 6-(4-methoxyphenyl)-6-oxohexanenitrile | ||
|---|---|---|---|---|
| CAS Number | 29395-08-2 | Molecular Weight | 217.26400 | |
| Density | 1.063g/cm3 | Boiling Point | 404.1ºC at 760 mmHg | |
| Molecular Formula | C13H15NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 176.7ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-(4-methoxyphenyl)-6-oxohexanenitrile |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.063g/cm3 |
|---|---|
| Boiling Point | 404.1ºC at 760 mmHg |
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.26400 |
| Flash Point | 176.7ºC |
| Exact Mass | 217.11000 |
| PSA | 50.09000 |
| LogP | 2.96188 |
| Vapour Pressure | 9.7E-07mmHg at 25°C |
| Index of Refraction | 1.512 |
| InChIKey | BMKMHMPWYIQLKG-UHFFFAOYSA-N |
| SMILES | COc1ccc(C(=O)CCCCC#N)cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2926909090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~52%
6-(4-methoxyphe... CAS#:29395-08-2 |
| Literature: Wang, Teng; Jiao, Ning Journal of the American Chemical Society, 2013 , vol. 135, # 32 p. 11692 - 11695 |
|
~%
6-(4-methoxyphe... CAS#:29395-08-2 |
| Literature: Wang, Teng; Jiao, Ning Journal of the American Chemical Society, 2013 , vol. 135, # 32 p. 11692 - 11695 |
|
~%
6-(4-methoxyphe... CAS#:29395-08-2 |
| Literature: Wang, Teng; Jiao, Ning Journal of the American Chemical Society, 2013 , vol. 135, # 32 p. 11692 - 11695 |
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 section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: SMILES notation of 6-(4-methoxyphenyl)-6-oxohexanenitrile is COc1ccc(C(=O)CCCCC#N)cc1. |
| Q: What is the English name of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: The English name of 6-(4-methoxyphenyl)-6-oxohexanenitrile is 6-(4-methoxyphenyl)-6-oxohexanenitrile. |
| Q: What is the polar surface area (PSA) of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: Polar surface area (PSA) of 6-(4-methoxyphenyl)-6-oxohexanenitrile is 50.09000. |
| Q: What is the Chinese name of 29395-08-2? |
| A: Chinese name of 29395-08-2 is 29395-08-2. |
| Q: What is the CAS number of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: CAS number of 6-(4-methoxyphenyl)-6-oxohexanenitrile is 29395-08-2. |
| Q: What is the molecular formula of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: Molecular formula of 6-(4-methoxyphenyl)-6-oxohexanenitrile is C13H15NO2. |
| Q: What is the boiling point of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: Boiling point of 6-(4-methoxyphenyl)-6-oxohexanenitrile is 404.1ºC at 760 mmHg. |
| Q: What is the InChIKey of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: InChIKey of 6-(4-methoxyphenyl)-6-oxohexanenitrile is BMKMHMPWYIQLKG-UHFFFAOYSA-N. |
| Q: What is the LogP of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: LogP of 6-(4-methoxyphenyl)-6-oxohexanenitrile is 2.96188. |
| Q: What is the molecular weight of 6-(4-methoxyphenyl)-6-oxohexanenitrile? |
| A: Molecular weight of 6-(4-methoxyphenyl)-6-oxohexanenitrile is 217.26400. |
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. |