Introduction：Basic information about CAS 22364-68-7|2-(o-Tolyl)acetonitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(o-Tolyl)acetonitrile |
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| CAS Number | 22364-68-7 | Molecular Weight | 131.174 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 244.0±0.0 °C at 760 mmHg |
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| Molecular Formula | C9H9N | Melting Point | 58 - 59ºC |
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| MSDS | / | Flash Point | 111.3±5.1 °C |
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Names
| Name | (2-methylphenyl)acetonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 244.0±0.0 °C at 760 mmHg |
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| Melting Point | 58 - 59ºC |
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| Molecular Formula | C9H9N |
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| Molecular Weight | 131.174 |
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| Flash Point | 111.3±5.1 °C |
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| Exact Mass | 131.073502 |
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| PSA | 23.79000 |
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| LogP | 1.91 |
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| Vapour Pressure | 0.0±0.4 mmHg at 25°C |
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| Index of Refraction | 1.527 |
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| InChIKey | WMGVPDQNPUQRND-UHFFFAOYSA-N |
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| SMILES | Cc1ccccc1CC#N |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AM2290000
- CHEMICAL NAME :
- Acetonitrile, o-tolyl-
- CAS REGISTRY NUMBER :
- 22364-68-7
- BEILSTEIN REFERENCE NO. :
- 0907182
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C9-H9-N
- MOLECULAR WEIGHT :
- 131.19
- WISWESSER LINE NOTATION :
- NC1R B1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02089
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Safety Information
| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R20/21/22 |
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| Safety Phrases | S36/37-S37/39-S27-S26 |
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| RIDADR | 3439 |
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| RTECS | AM2290000 |
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| Packaging Group | III |
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| Hazard Class | 6.1 |
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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
| 2-(o-Tolyl)acetonitrile |
| MFCD00001904 |
| 2-Methylphenylacetonitrile 2-Methylbenzyl cyanide |
| O-Methylbenzyl cyanide |
| EINECS 244-937-5 |
| Benzeneacetonitrile, 2-methyl- |
| o-Methylphenylacetonitrile |
| o-Tolylacetonitrile |
| 2-Methylphenylacetonitrile |
| (2-Methylphenyl)acetonitrile |
| 2-methylbenzoacetonitrile |
| 2-Methylbenzyl cyanide |
| o-Xylyl Cyanide |
