104-47-2
p-methoxy phenylacetonitrile
CAS: 104-47-2
Molecular Formula: C9H9NO
104-47-2 - Names and Identifiers
| Name | p-methoxy phenylacetonitrile |
| Synonyms | ANISYL CYANIDE p-Anisyl cyanide Anisylacetonitrile p-Methoxybenzyl cyanide 4-Methoxybenzyl cyanide 4-Methoxyphenylacetonitrile 4-METHOXYBENZENEACETONITRILE p-methoxy phenylacetonitrile p-Methoxybenzeneacetonitrile 4-Methyoxy phenylacetonitrile (4-Methoxyphenyl)acetonitrile Acetonitrile, (p-methoxypenyl)- Benzeneacetonitrile, 4-methoxy- 2-(4-METHOXYPHENYL)ACETONITRILE Acetonitrile, (p-methoxyphenyl)- |
| CAS | 104-47-2 |
| EINECS | 203-206-0 |
| InChI | InChI=1/C9H9NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6H2,1H3 |
| InChIKey | PACGLQCRGWFBJH-UHFFFAOYSA-N |
104-47-2 - Physico-chemical Properties
| Molecular Formula | C9H9NO |
| Molar Mass | 147.17 |
| Density | 1.085 g/mL at 25 °C (lit.) |
| Melting Point | 8 °C |
| Boling Point | 286-287 °C (lit.) |
| Flash Point | >230°F |
| Solubility | 0.01g/l |
| Vapor Presure | 0.00263mmHg at 25°C |
| Appearance | Liquid |
| Specific Gravity | 1.085 |
| Color | Clear colorless to slightly yellow |
| Exposure Limit | NIOSH: IDLH 25 mg/m3 |
| BRN | 509162 |
| PH | 4.5 (100g/l, H2O, 20℃)suspension |
| Storage Condition | Sealed in dry,Room Temperature |
| Explosive Limit | 1.2-9.4%(V) |
| Refractive Index | n20/D 1.531(lit.) |
| Physical and Chemical Properties | Liquid. Boiling point 286-287 ℃, relative density 1.085, refractive index 1.5300, flash point 110 ℃. |
| Use | Used as an intermediate in organic synthesis for the synthesis of β-(p-methoxybenzene) ethylamine |
104-47-2 - 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. R52/53 - Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. R25 - Toxic if swallowed |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S37/39 - Wear suitable gloves and eye/face protection S36/37 - Wear suitable protective clothing and gloves. S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S36 - Wear suitable protective clothing. |
| UN IDs | UN 3276 6.1/PG 3 |
| WGK Germany | 3 |
| RTECS | AM0810000 |
| FLUKA BRAND F CODES | 8 |
| TSCA | Yes |
| HS Code | 29269095 |
| Hazard Class | 6.1 |
| Packing Group | III |
104-47-2 - Reference Information
| NIST chemical information | information provided by: webbook.nist.gov (external link) |
| EPA chemical substance information | information provided by: ofmpeb.epa.gov (external link) |
| uses | intermediates for antidepressants. An intermediate in organic synthesis for the synthesis of β-(p-methoxybenzene) ethylamine. used as intermediate in organic synthesis for the synthesis of β-(p-methoxybenzene) ethylamine |
| production method | is prepared by nitrilation of p-methoxychlorobenzyl. |
Last Update：2024-04-09 20:45:29
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