(3,4-Dimethoxyphenyl)acetonitrile
Catalog No: FT-0614353
CAS No: 93-17-4
- Chemical Name: (3,4-Dimethoxyphenyl)acetonitrile
- Molecular Formula: C10H11NO2
- Molecular Weight: 177.2
- InChI Key: ASLSUMISAQDOOB-UHFFFAOYSA-N
- InChI: InChI=1S/C10H11NO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5H2,1-2H3
| Assay | Pack Size | 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: | 93-17-4 |
| Flash_Point: | 116.6±16.4 °C |
| Product_Name: | 3,4-Dimethoxyphenylacetonitrile |
| Bolling_Point: | 319.7±0.0 °C at 760 mmHg |
| FW: | 177.200 |
| Melting_Point: | 54-57 °C(lit.) |
| MF: | C10H11NO2 |
| Density: | 1.1±0.1 g/cm3 |
| Refractive_Index: | 1.512 |
|---|---|
| Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
| Flash_Point: | 116.6±16.4 °C |
| LogP: | 1.19 |
| Bolling_Point: | 319.7±0.0 °C at 760 mmHg |
| Water_Solubility: | insoluble |
| FW: | 177.200 |
| PSA: | 42.25000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 422 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :196 ', '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: | 54-57 °C(lit.) |
| MF: | C10H11NO2 |
| Exact_Mass: | 177.078979 |
| Molecular_Structure: | ['1 . Molar refractive index 4907 ', '2 . Molar volume （m3/mol）1636 ', '3 . Parachor （902K）4055 ', '4 . Surface tension 377 ', '5 . Polarizability （10 -24cm 3）1945'] |
| Density: | 1.1±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Solid 结晶 ', '2 . Density（g/mL,25/4℃）1053 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）64-66 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,133kPa）171-178 ', '7 . Refractive index Unknow ', '8 . Flash point（ºC） 250 ', '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'] |
| Symbol: | GHS07 |
|---|---|
| RIDADR: | 3276 |
| HS_Code: | 2926909090 |
| Packing_Group: | I; II; III |
| Hazard_Class: | 6.1 |
| Risk_Statements(EU): | R22;R23/24/25 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| RTECS: | AL9325000 |
| Hazard_Codes: | T:Toxic;Xn:Harmful; |
| Safety_Statements: | H302 |
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