CAS 1527-89-5|3-Methoxybenzonitrile
Introduction：Basic information about CAS 1527-89-5|3-Methoxybenzonitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-Methoxybenzonitrile | ||
|---|---|---|---|
| CAS Number | 1527-89-5 | Molecular Weight | 133.147 |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 233.2±0.0 °C at 760 mmHg |
| Molecular Formula | C8H7NO | Melting Point | 20-22°C |
| MSDS | ChineseUSA | Flash Point | 105.0±0.0 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 3-Methoxybenzonitrile |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 233.2±0.0 °C at 760 mmHg |
| Melting Point | 20-22°C |
| Molecular Formula | C8H7NO |
| Molecular Weight | 133.147 |
| Flash Point | 105.0±0.0 °C |
| Exact Mass | 133.052765 |
| PSA | 33.02000 |
| LogP | 1.45 |
| Vapour Pressure | 0.1±0.4 mmHg at 25°C |
| Index of Refraction | 1.527 |
| InChIKey | KLXSUMLEPNAZFK-UHFFFAOYSA-N |
| SMILES | COc1cccc(C#N)c1 |
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 + H312 + H332-H315-H319-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R20/21/22 |
| Safety Phrases | S26-S37/39-S36/37 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 2926909090 |
Customs
| HS Code | 2926909090 |
|---|---|
| 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% |
Articles5
More Articles| Vibrational analysis of substituted benzonitriles. III. Transferability of force constants--the case of some halogeno-, methoxy- and nitro-benzonitriles. Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 53A(12) , 2041-8, (1997) A zero-order normal coordinate analysis of both the in-plane and out-of-plane vibrations was made for 2-chloro, 6-fluorobenzonitrile, s-trichlorobenzonitrile, p- and m-methoxybenzonitriles and m-nitro... | |
| Theoretical surface-enhanced Raman spectra study of substituted benzenes II. Density functional theoretical SERS modelling of o-, m-, and p-methoxybenzonitrile. Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 71(3) , 1074-9, (2008) The SERS modelling of o-, m-, and p-methoxybenzonitrile has been performed following the same methodology that in Part I. Optimized structure obtained from DFT calculations in a B3LYP-LANL2DZ level of... | |
| [Catalysts for demethylation of methoxybenzonitrile in liquid-phase (author's transl)]. Yakugaku Zasshi 100(6) , 668-71, (1980) |
Synonyms
| Benzonitrile,3-methoxy |
| 3-methoxybenzylnitrile |
| 3-Methoxybenzonitrile |
| m-Anisonitrile (8CI) |
| 3-Cyanoanisole |
| MFCD00001801 |
| m-cyanoanisole |
| EINECS 216-201-3 |
| m-MeOC6H4CN |
| m-Methoxybenzonitrile |
| 1-cyano-3-methoxybenzene |
| 3-Methoxybenzolcarbonitril |
| m-Methoxybenzontrile |
| 3-anisonitrile |
| Benzonitrile, 3-methoxy- |
| m-Anisonitrile |
| 3-methoxy-benzonitrile |
| Benzonitrile, m-methoxy- |
