Benzoylacetonitrile
Catalog No: FT-0612106
CAS No: 614-16-4
- Molecular Formula: 145.16
- Formula Weight: C9H7NO
- Inchl Key: ZJRCIQAMTAINCB-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H7NO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6H2
| 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: | GHS07 |
|---|---|
| CAS: | 614-16-4 |
| Flash_Point: | 132.9±22.6 °C |
| Product_Name: | 3-Oxo-3-phenylpropanenitrile |
| Bolling_Point: | 301.5±0.0 °C at 760 mmHg |
| FW: | 145.158 |
| Melting_Point: | 82-83 °C(lit.) |
| MF: | C9H7NO |
| Density: | 1.1±0.1 g/cm3 |
| Refractive_Index: | 1.536 |
|---|---|
| Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
| Flash_Point: | 132.9±22.6 °C |
| LogP: | 0.97 |
| Bolling_Point: | 301.5±0.0 °C at 760 mmHg |
| Water_Solubility: | slightly soluble |
| PSA: | 40.86000 |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 4082 ', '2 . Molar volume 1308 ', '3 . Parachor （902K）3405 ', '4 . Surface tension 458 ', '5 . Polarizability 1618'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :2 ', '6. TPSA 409 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :183 ', '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: | 82-83 °C(lit.) |
| MF: | C9H7NO |
| Exact_Mass: | 145.052765 |
| FW: | 145.158 |
| Density: | 1.1±0.1 g/cm3 |
| More_Info: | ['1 . Melting point（℃）82-83 ', '2. Boiling point（ºC） 160（1333pa） ', '3. Solubility 微Soluble in Water ，Soluble in Ethanol Ethyl ether 苯氯仿。 ', '4 . Appearance White 结晶性粉末。'] |
| Symbol: | GHS07 |
|---|---|
| RIDADR: | 3276 |
| HS_Code: | 2926909090 |
| Packing_Group: | III |
| Risk_Statements(EU): | R20/21/22;R36/37/38 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard_Codes: | Xn:Harmful |
| Warning_Statement: | P261-P280-P305 + P351 + P338 |
| Safety_Statements: | H302 + H312 + H332-H315-H319-H335 |
