Introduction：Basic information about CAS 1885-35-4|3,4,5-Trimethoxybenzonitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,4,5-Trimethoxybenzonitrile |
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| CAS Number | 1885-35-4 | Molecular Weight | 193.199 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 329.7±0.0 °C at 760 mmHg |
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| Molecular Formula | C10H11NO3 | Melting Point | 91-94 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 116.0±20.2 °C |
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| Symbol |
GHS07 | Signal Word | Warning |
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Names
| Name | 3,4,5-Trimethoxybenzonitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 329.7±0.0 °C at 760 mmHg |
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| Melting Point | 91-94 °C(lit.) |
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| Molecular Formula | C10H11NO3 |
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| Molecular Weight | 193.199 |
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| Flash Point | 116.0±20.2 °C |
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| Exact Mass | 193.073898 |
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| PSA | 51.48000 |
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| LogP | 1.15 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.515 |
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| InChIKey | OSBQUSPVORCDCU-UHFFFAOYSA-N |
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| SMILES | COc1cc(C#N)cc(OC)c1OC |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DI4965000
- CHEMICAL NAME :
- Benzonitrile, 3,4,5-trimethoxy-
- CAS REGISTRY NUMBER :
- 1885-35-4
- BEILSTEIN REFERENCE NO. :
- 0979686
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C10-H11-N-O3
- MOLECULAR WEIGHT :
- 193.22
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1500 mg/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 + H332-H315-H319-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 | R21/22;R36/37/38 |
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| Safety Phrases | S26-S37/39 |
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| RIDADR | 3276 |
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| WGK Germany | 3 |
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| RTECS | DI4965000 |
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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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Articles2
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| Characterization of nitrile hydratation catalysed by Nocardia sp. 108. Wang Y-J, et al. World J. Microbiol. Biotechnol. 23(3) , 355-362, (2007)
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| Room-temperature discotic liquid-crystalline coronene diimides exhibiting high charge-carrier mobility in air. An Z,et al. J. Mater. Chem. 19(37) , 6688-6698, (2009)
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Synonyms
| NCR CO1 DO1 EO1 |
| MFCD00001803 |
| Benzonitrile, 3,4,5-tri-methoxy- |
| 5-Cyan-pyrogallol-trimethylaether |
| Benzonitrile, 3,4,5-trimethoxy- |
| 3,4,5-Trimethoxybenzonitrile |
| 3.4.5-Trimethoxy-benzoesaeure-nitril |
| 3,4,5-Trimethoxybenzenecarbonitrile |
| 3,4,5-trimethoxy-benzonitrile |
| 3,4,5-Trimethoxy-benzonitril |
| Trimethylaethergallussaeure-nitril |
| EINECS 217-550-4 |
| BENZONITRILE,3,4,5-TRIMETHOXY |
| 3,4,5-Trimethoxybenzolcarbonitril |
