3-(4-Methoxyphenyl)-3-oxopropanenitrile, 4-(Cyanoacetyl)anisole
4-Methoxybenzoylacetonitrile
CAS: 3672-47-7
Molecular Formula: C10H9NO2
3-(4-Methoxyphenyl)-3-oxopropanenitrile, 4-(Cyanoacetyl)anisole - Names and Identifiers
| Name | 4-Methoxybenzoylacetonitrile |
| Synonyms | AKOS BB-9547 4-METHOXYBENZOYLACETONITRILE 4-Methoxybenzoylacetonitrile 4-Metthoxybenzoylacetonitrile 4-Methoxy Benzyl Acetonitrile 3-(4-METHOXYPHENYL)-3-OXOPROPANENITRILE 3-(4-Methoxyphenyl)-3-oxopropanenitrile 3-(4'-METHOXYPHENYL)-3-OXOPROPANENITRILE 3-(4-Methoxyphenyl)-3-oxopropanenitrile, 4-(Cyanoacetyl)anisole |
| CAS | 3672-47-7 |
| EINECS | 678-864-9 |
| InChI | InChI=1/C10H9NO2/c1-13-9-4-2-8(3-5-9)10(12)6-7-11/h2-5H,6H2,1H3 |
| InChIKey | IKEPUFCALLUUBC-UHFFFAOYSA-N |
3-(4-Methoxyphenyl)-3-oxopropanenitrile, 4-(Cyanoacetyl)anisole - Physico-chemical Properties
| Molecular Formula | C10H9NO2 |
| Molar Mass | 175.18 |
| Density | 1.131±0.06 g/cm3(Predicted) |
| Melting Point | 129-132 °C |
| Boling Point | 364.4±22.0 °C(Predicted) |
| Flash Point | 159.3°C |
| Vapor Presure | 1.69E-05mmHg at 25°C |
| Appearance | Crystalline Powder |
| Color | Yellow |
| BRN | 743909 |
| pKa | 8.27±0.10(Predicted) |
| Storage Condition | Sealed in dry,Store in freezer, under -20°C |
| Refractive Index | 1.525 |
| MDL | MFCD00067889 |
3-(4-Methoxyphenyl)-3-oxopropanenitrile, 4-(Cyanoacetyl)anisole - Risk and Safety
| Risk Codes | R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. R25 - Toxic if swallowed |
| Safety Description | S36/37 - Wear suitable protective clothing and gloves. S60 - This material and its container must be disposed of as hazardous waste. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S20 - When using, do not eat or drink. |
| UN IDs | 3276 |
| WGK Germany | 3 |
| HS Code | 29269095 |
| Packing Group | III |
3-(4-Methoxyphenyl)-3-oxopropanenitrile, 4-(Cyanoacetyl)anisole - Introduction
It is an organic compound with the chemical formula C10H9NO2. The following is a description of its nature, use, preparation and safety information:
Nature:
is a solid with a pale yellow crystalline appearance. It is stable at room temperature and can be dissolved in organic solvents such as ethanol, dichloromethane and chloroform. Its melting point is about 74-76°C.
Use:
As an important chemical intermediate, it is often used in organic synthesis reactions. It can be used as a starting material for the synthesis of other organic compounds, such as methyl benzoate, ethyl 4-methoxybenzoate, etc. In addition, it can also be used as a pharmaceutical raw material for the preparation of drugs or biologically active compounds.
Preparation Method: The preparation method of
is generally obtained by reacting p-methoxybenzoyl chloride with acetonitrile. Specific reaction conditions and procedures can refer to the organic synthesis of laboratory manuals or literature.
Safety Information:
Appropriate protective measures should be taken when handling the phosphor. It can irritate the eyes, skin and respiratory tract, so wear protective glasses, gloves and respiratory protection during operation. Avoid inhalation and contact with skin. When using or storing, please keep it properly and keep it away from fire and oxidant. In case of accidental contact, rinse immediately with plenty of water and seek medical treatment if necessary. Observe the relevant safety practices and regulations when handling this compound.
Nature:
is a solid with a pale yellow crystalline appearance. It is stable at room temperature and can be dissolved in organic solvents such as ethanol, dichloromethane and chloroform. Its melting point is about 74-76°C.
Use:
As an important chemical intermediate, it is often used in organic synthesis reactions. It can be used as a starting material for the synthesis of other organic compounds, such as methyl benzoate, ethyl 4-methoxybenzoate, etc. In addition, it can also be used as a pharmaceutical raw material for the preparation of drugs or biologically active compounds.
Preparation Method: The preparation method of
is generally obtained by reacting p-methoxybenzoyl chloride with acetonitrile. Specific reaction conditions and procedures can refer to the organic synthesis of laboratory manuals or literature.
Safety Information:
Appropriate protective measures should be taken when handling the phosphor. It can irritate the eyes, skin and respiratory tract, so wear protective glasses, gloves and respiratory protection during operation. Avoid inhalation and contact with skin. When using or storing, please keep it properly and keep it away from fire and oxidant. In case of accidental contact, rinse immediately with plenty of water and seek medical treatment if necessary. Observe the relevant safety practices and regulations when handling this compound.
Last Update：2024-04-09 20:49:11
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