Benzonitrile structure
|
Common Name | Benzonitrile | ||
|---|---|---|---|---|
| CAS Number | 100-47-0 | Molecular Weight | 103.121 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 191.1±0.0 °C at 760 mmHg | |
| Molecular Formula | C7H5N | Melting Point | -13 °C | |
| MSDS | Chinese USA | Flash Point | 71.7±0.0 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
| Name | benzonitrile |
|---|---|
| Synonym | More Synonyms |
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 191.1±0.0 °C at 760 mmHg |
| Melting Point | -13 °C |
| Molecular Formula | C7H5N |
| Molecular Weight | 103.121 |
| Flash Point | 71.7±0.0 °C |
| Exact Mass | 103.042198 |
| PSA | 23.79000 |
| LogP | 1.65 |
| Vapour Pressure | 0.5±0.3 mmHg at 25°C |
| Index of Refraction | 1.539 |
| Stability | Stable. Incompatible with strong bases, strong acids, strong oxidizing agents, strong reducing agents. Air-sensitive. Combustible. |
| Water Solubility | 10 g/L (100 ºC) |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
MUTATION DATA
|
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 + H312 |
| Precautionary Statements | P280-P301 + P312 + P330 |
| 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 | R21/22 |
| Safety Phrases | S23 |
| RIDADR | UN 2224 6.1/PG 2 |
| WGK Germany | 2 |
| RTECS | DI2450000 |
| Packaging Group | II |
| Hazard Class | 6.1 |
| HS Code | 2926909090 |
| Precursor 0 | |
|---|---|
| DownStream 10 | |
| 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% |
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Bioorg. Med. Chem. 17 , 896-904, (2009) This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoret... |
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Dielectric behaviors of typical benzene monosubstitutes, bromobenzene and benzonitrile.
J. Phys. Chem. B 116(41) , 12605-13, (2012) The dielectric behaviors of typical benzene monosubstitutes, bromobenzene (Br-Bz) and benzonitrile (NC-Bz), were investigated up to 3 THz in the pure liquid state over a temperature range from 10 to 6... |
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Calculating virtual log P in the alkane/water system (log P(N)(alk)) and its derived parameters deltalog P(N)(oct-alk) and log D(pH)(alk).
J. Med. Chem. 48 , 3269-79, (2005) Growing interest in the use of both the logarithm of the partition coefficient of the neutral species in the alkane/water system (log P(N)(alk)) and the difference between log P(N)(oct) (the logarithm... |
| EINECS 202-855-7 |
| MFCD00001770 |
| cyanobenzene |
| phenyl cyanide |
| Benzonitrile |