3-PHENYLPROPIONITRILE
Catalog No: FT-0649505
CAS No: 645-59-0
- Molecular Formula: 131.17
- Formula Weight: C9H9N
- Inchl Key: ACRWYXSKEHUQDB-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H9N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Symbol: | GHS06 |
|---|---|
| CAS: | 645-59-0 |
| Flash_Point: | >230 °F |
| Product_Name: | 3-phenylpropionitrile |
| Bolling_Point: | 113 °C9 mm Hg(lit.) |
| FW: | 131.17400 |
| Melting_Point: | −2-−1 °C(lit.) |
| MF: | C9H9N |
| Density: | 1.001 g/mL at 25 °C(lit.) |
| Refractive_Index: | n20/D 1.521(lit.) |
|---|---|
| Flash_Point: | >230 °F |
| LogP: | 2.14278 |
| Bolling_Point: | 113 °C9 mm Hg(lit.) |
| PSA: | 23.79000 |
| Molecular_Structure: | ['1 . Molar refractive index 4034 ', '2 . Molar volume 1321 ', '3 . Parachor （902K）3319 ', '4 . Surface tension 398 ', '5 . Polarizability 1599'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :125 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | −2-−1 °C(lit.) |
| MF: | C9H9N |
| Exact_Mass: | 131.07300 |
| FW: | 131.17400 |
| Density: | 1.001 g/mL at 25 °C(lit.) |
| More_Info: | ['1 . Appearance 有毒Liquid 。 ', '2 . Density（g/mL,25/4℃）1008 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-1 ', '5 . Boiling point（ºC,Atmospheric pressure）261，141ºC（3333pa） ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index(n28D)1521 ', '8 . Flash point（ºC） ＞110 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Soluble in Ethanol Ethyl ether ，微Soluble in 氯仿。'] |
| Symbol: | GHS06 |
|---|---|
| RIDADR: | UN 3276 6.1/PG 3 |
| HS_Code: | 2926909090 |
| Packing_Group: | II |
| Hazard_Class: | 6.1 |
| Risk_Statements(EU): | R25 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| RTECS: | MW5604750 |
| Hazard_Codes: | T:Toxic; |
| Warning_Statement: | P261-P280-P301 + P310-P311 |
| Safety_Statements: | H301 + H311 + H331 |
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