2,5-Dimethylphenylacetonitrile
Catalog No: FT-0610474
CAS No: 16213-85-7
- Molecular Formula: 145.2
- Formula Weight: C10H11N
- Inchl Key: HCELORQTHSKCQL-UHFFFAOYSA-N
- Inchl: InChI=1S/C10H11N/c1-8-3-4-9(2)10(7-8)5-6-11/h3-4,7H,5H2,1-2H3
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | 27-29 °C |
|---|---|
| CAS: | 16213-85-7 |
| MF: | C10H11N |
| Flash_Point: | 73°C/1mm |
| Product_Name: | 2,5-Dimethylphenylacetonitrile |
| Density: | 0.979g/cm3 |
| FW: | 145.20100 |
| Bolling_Point: | 73°C 1mm |
| Refractive_Index: | 1.524 |
|---|---|
| Vapor_Pressure: | 0.015mmHg at 25°C |
| Flash_Point: | 73°C/1mm |
| LogP: | 2.36948 |
| Bolling_Point: | 73°C 1mm |
| PSA: | 23.79000 |
| Molecular_Structure: | ['1 . Molar refractive index 4536 ', '2 . Molar volume （m3/mol）1481 ', '3 . Parachor （902K）3674 ', '4 . Surface tension 378 ', '5 . Polarizability 1798'] |
| Computational_Chemistry: | ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :165 ', '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: | 27-29 °C |
| MF: | C10H11N |
| Exact_Mass: | 145.08900 |
| FW: | 145.20100 |
| Density: | 0.979g/cm3 |
| More_Info: | ['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）27-29 °C 5 . Boiling point（ºC,Atmospheric pressure） 73°C 1mm 6 . Boiling point（ºC,52kPa） Unknow ', '7. Refractive indexUnknow 8 . Flash point（ºC） 73°C/1mm 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 Unknow'] |
| Hazard_Class: | 6.1 |
|---|---|
| Risk_Statements(EU): | R36/37/38 |
| RTECS: | AM2675000 |
| RIDADR: | 3276 |
| Hazard_Codes: | Xi:Irritant; |
| HS_Code: | 2926909090 |
| Safety_Statements: | S37/39-S26 |
| Packing_Group: | III |
Related Products
3,4-Pyrrolidinediol, 2-[(4-methoxyphenyl)methyl]-, 3-acetate, (2S,3R,4R)-
(4S)-2-[[[(2R)-2-AMino-2-(4-hydroxyphenyl)acetyl]aMino]Methyl]-5,5-diMethyl-4-thiazolidinecarboxylic Acid (Mixture of DiastereoMers)