| Name | n-Butylbenzene |
| Synonyms | BUTYLBENZENE 1-PHENYLBUTANE 1-butylbenzene n-Butylbenzene N-BUTYLBENZENE Normal Butyl Benzene n-Butylbenzene Standard 1-Phenylbutane Butylbenzene Benzene |
| CAS | 104-51-8 |
| EINECS | 203-209-7 |
| InChI | InChI=1/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3 |
| Molecular Formula | C10H14 |
| Molar Mass | 134.22 |
| Density | 0.86 |
| Melting Point | -88℃ |
| Boling Point | 183℃ |
| Flash Point | 59℃ |
| Water Solubility | INSOLUBLE |
| Vapor Presure | 1.03 mm Hg ( 23 °C) |
| Refractive Index | 1.488 |
| Physical and Chemical Properties | Chemical colorless liquid. Melting point -88.5 ℃, boiling point 183.1 ℃,116.2 ℃(13.3kPa),62.2 ℃(133Pa), relative density 0.8601(20/4 ℃), refractive index 1.4898, flash point 59 ℃. It is miscible with ethanol, ether, acetone, benzene, carbon tetrachloride, petroleum ether, and insoluble in water. |
| Use | Mainly used as solvents and raw materials for organic synthesis |
| Risk Codes | R10 - Flammable |
| Safety Description | S16 - Keep away from sources of ignition. |
| UN IDs | UN 2709 |
| melting point | -88 °C |
| boiling point | 183 °C(lit.) |
| density | 0.86 g/mL at 25 °C(lit.) |
| vapor density | >1 (vs air) |
| Vapor pressure | 1.03mm Hg ( 23 °C) |
| refractive index | n20/D 1.489(lit.) |
| flash point | 139 °F |
| storage conditions | 2-8°C |
| solubility | 11.8mg/l |
| acidity coefficient (pKa) | >14 (Schwarzenbach et al., 1993) |
| morphology | Liquid |
| color | Clear colorless |
| explosion limit value (explosive limit) | 0.8-5.8%(V) |
| olfactory threshold (Odor Threshold) | 0.0085ppm |
| water solubility | INSOLUBLE |
| Merck | 14,1549 |
| BRN | 1903395 |
| Henry's Law Constant | 12.7 at 45.00 °C, 14.1 at 50.00 °C, 15.7 at 55.00 °C, 17.3 at 60.00 °C, 18.9 at 65.00 °C, 22.2 at 70.00 °C, 26.1 at 80.00°C (static headspace-GC, Park et al., 2004) |
| stability | Stable. Flammable. Incompatible with strong oxidizing agents. |
| InChIKey | OCKPCBLVNKHBMX-UHFFFAOYSA-N |
| NIST chemical information | Benzene, butyl-(104-51-8) |
| EPA chemical information | n-Butylbenzene (104-51-8) |
| dangerous goods mark | F,T,N |
| hazard category code | 10-39/23/24/25-23/24/25-11-50/53 |
| safety instructions | 16-45-36/37-7-61-60 |
| dangerous goods transport number | UN 2709 3/PG 3 |
| WGK Germany | 3 |
| RTECS number | CY9070000 |
| auto-ignition temperature | 774 °F |
| TSCA | Yes |
| customs code | 2902 90 00 |
| HazardClass | 3 |
| PackingGroup | III |
| toxic substance data | 104-51-8(Hazardous Substances Data) |
| production method | It is prepared by hydrogenation of phenylbutanone or by the reaction of bromobenzene and 1-bromobutane. |
| category | flammable liquid |
| toxicity classification | low toxicity |
| acute toxicity | oral-rat LDL0: 8750 mg/kg |
| explosive hazard characteristics | Blowing with air |
| flammability hazard characteristics | Combustible in case of open flame, high temperature and strong oxidant; combustion emission stimulates smoke |
| storage and transportation characteristics | The package is complete, light and light to unload; the warehouse is ventilated, away from open flames, high temperature, and stored separately from the oxidant |
| fire extinguishing agent | foam, dry powder, carbon dioxide |