Introduction：Basic information about CAS 19179-31-8|3,5-Dimethoxybenzonitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,5-Dimethoxybenzonitrile |
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| CAS Number | 19179-31-8 | Molecular Weight | 163.173 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 261.4±30.0 °C at 760 mmHg |
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| Molecular Formula | C9H9NO2 | Melting Point | 87-89 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 104.9±17.8 °C |
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| Symbol |
GHS07 | Signal Word | Warning |
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Names
| Name | 3,5-Dimethoxybenzonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 261.4±30.0 °C at 760 mmHg |
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| Melting Point | 87-89 °C(lit.) |
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| Molecular Formula | C9H9NO2 |
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| Molecular Weight | 163.173 |
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| Flash Point | 104.9±17.8 °C |
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| Exact Mass | 163.063324 |
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| PSA | 42.25000 |
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| LogP | 1.12 |
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| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
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| Index of Refraction | 1.520 |
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| InChIKey | NVTHWSJNXVDIKR-UHFFFAOYSA-N |
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| SMILES | COc1cc(C#N)cc(OC)c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DI4355800
- CHEMICAL NAME :
- Benzonitrile, 3,5-dimethoxy-
- CAS REGISTRY NUMBER :
- 19179-31-8
- BEILSTEIN REFERENCE NO. :
- 0776115
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C9-H9-N-O2
- MOLECULAR WEIGHT :
- 163.19
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 41,41,1986
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Safety Information
| Symbol |
GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H302-H312-H315-H319-H332-H335 |
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| Precautionary Statements | P261-P280-P305 + P351 + P338 |
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| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
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| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R20/21/22 |
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| Safety Phrases | S26-S36-S36/37 |
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| RIDADR | 3276 |
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| WGK Germany | 3 |
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| RTECS | DI4355800 |
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| Packaging Group | III |
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| Hazard Class | 6.1 |
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Synonyms
| MFCD00001804 |
| 3,5-Dimethoxybenzonitrile |
| 3,5-dimethoxy-benzonitrile |
| Benzonitrile, 3,5-dimethoxy- |
| 3.5-Dimethoxy-benzoesaeure-nitril |
| 3,5-dimethoxybenzenecarbonitrile |
| 3,5-Dimethoxy-benzonitril |
| 3,5-Dimethoxybenzolcarbonitril |
| BENZONITRILE,3,5-DIMETHOXY |
| EINECS 242-858-0 |
