3-(3-methoxyphenyl)prop-2-enenitrile
3-(3-methoxyphenyl)prop-2-enenitrile structure
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Common Name | 3-(3-methoxyphenyl)prop-2-enenitrile | ||
|---|---|---|---|---|
| CAS Number | 28446-69-7 | Molecular Weight | 159.18500 | |
| Density | 1.077g/cm3 | Boiling Point | 299.6ºC at 760mmHg | |
| Molecular Formula | C10H9NO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 126.2ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-(3-methoxyphenyl)prop-2-enenitrile |
|---|---|
| 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 | 1.077g/cm3 |
|---|---|
| Boiling Point | 299.6ºC at 760mmHg |
| Molecular Formula | C10H9NO |
| Molecular Weight | 159.18500 |
| Flash Point | 126.2ºC |
| Exact Mass | 159.06800 |
| PSA | 33.02000 |
| LogP | 2.23198 |
| Vapour Pressure | 0.00118mmHg at 25°C |
| Index of Refraction | 1.573 |
| InChIKey | CDGKYGSIBOJVCY-HWKANZROSA-N |
| SMILES | COc1cccc(C=CC#N)c1 |
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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~61%
3-(3-methoxyphe... CAS#:28446-69-7 |
| Literature: Rigel Pharmaceuticals, Inc.; Goff, Dane; Payan, Donald G.; Braselmann, Sylvia Patent: US2013/237524 A1, 2013 ; Location in patent: Paragraph 0210 ; |
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~%
3-(3-methoxyphe... CAS#:28446-69-7 |
| Literature: Bol'shakova, S. A.; Goloshchapova, Zh. A.; Tuzhilkova, T. N.; Grebenyuk, A. D.; Myakishev, V. M. Pharmaceutical Chemistry Journal, 1983 , vol. 17, # 7 p. 474 - 476 Khimiko-Farmatsevticheskii Zhurnal, 1983 , vol. 17, # 7 p. 795 - 797 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 2 | |
CAS#:18655-52-2
CAS#:1129-59-5This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Methoxycinnamonitrile |
| m-Methoxycinnamonitrile |
| 2-Propenenitrile,3-(3-methoxyphenyl) |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: Molecular formula of 3-(3-methoxyphenyl)prop-2-enenitrile is C10H9NO. |
| Q: What is the molecular weight of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: Molecular weight of 3-(3-methoxyphenyl)prop-2-enenitrile is 159.18500. |
| Q: What is the boiling point of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: Boiling point of 3-(3-methoxyphenyl)prop-2-enenitrile is 299.6ºC at 760mmHg. |
| Q: What are the downstream products of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: Related downstream products(CAS) of 3-(3-methoxyphenyl)prop-2-enenitrile: 18655-52-2;1129-59-5. |
| Q: What is the SMILES notation of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: SMILES notation of 3-(3-methoxyphenyl)prop-2-enenitrile is COc1cccc(C=CC#N)c1. |
| Q: What is the polar surface area (PSA) of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: Polar surface area (PSA) of 3-(3-methoxyphenyl)prop-2-enenitrile is 33.02000. |
| Q: What are the upstream materials of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: Related upstream materials(CAS) of 3-(3-methoxyphenyl)prop-2-enenitrile: 372-09-8;591-31-1;536-90-3. |
| Q: What is the LogP of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: LogP of 3-(3-methoxyphenyl)prop-2-enenitrile is 2.23198. |
| Q: What is the Chinese name of 28446-69-7? |
| A: Chinese name of 28446-69-7 is 28446-69-7. |
| Q: What is the English name of 3-(3-methoxyphenyl)prop-2-enenitrile? |
| A: The English name of 3-(3-methoxyphenyl)prop-2-enenitrile is 3-(3-methoxyphenyl)prop-2-enenitrile. |