Introduction：Basic information about CAS 22442-48-4|3-(4-Methoxyphenyl)propionitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(4-Methoxyphenyl)propionitrile |
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| CAS Number | 22442-48-4 | Molecular Weight | 161.20000 |
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| Density | 1.032g/cm3 | Boiling Point | 308.5ºC at 760mmHg |
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| Molecular Formula | C10H11NO | Melting Point | / |
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| MSDS | / | Flash Point | 130.1ºC |
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Names
| Name | 3-(4-Methoxyphenyl)propionitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.032g/cm3 |
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| Boiling Point | 308.5ºC at 760mmHg |
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| Molecular Formula | C10H11NO |
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| Molecular Weight | 161.20000 |
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| Flash Point | 130.1ºC |
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| Exact Mass | 161.08400 |
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| PSA | 33.02000 |
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| LogP | 2.15138 |
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| Vapour Pressure | 0.000678mmHg at 25°C |
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| Index of Refraction | 1.514 |
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| InChIKey | ORAXBZFDDWPRRD-UHFFFAOYSA-N |
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| SMILES | COc1ccc(CCC#N)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- MW5604790
- CHEMICAL NAME :
- Hydrocinnamonitrile, p-methoxy-
- CAS REGISTRY NUMBER :
- 22442-48-4
- BEILSTEIN REFERENCE NO. :
- 2090556
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C10-H11-N-O
- MOLECULAR WEIGHT :
- 161.22
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 450 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 46,174,1983
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Safety Information
| Hazard Codes | Xi: Irritant; |
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| Risk Phrases | R20/21/22 |
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| Safety Phrases | 26-36/37/39 |
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| HS Code | 2926909090 |
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Customs
| HS Code | 2926909090 |
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| 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% |
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Synonyms
| 3-(4-methoxyphenyl)propanenitrile |
| MFCD00016404 |
