METHYL 3-CYANO-4-METHOXYBENZOATE
Catalog No: FT-0628553
CAS No: 25978-74-9
- Chemical Name: METHYL 3-CYANO-4-METHOXYBENZOATE
- Molecular Formula: C10H9NO3
- Molecular Weight: 191.18 g/mol
- InChI Key: RYJSFYBJYKFNCF-UHFFFAOYSA-N
- InChI: InChI=1S/C10H9NO3/c1-13-9-4-3-7(10(12)14-2)5-8(9)6-11/h3-5H,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 |
| Product_Name: | Methyl 3-cyano-4-methoxybenzoate |
|---|---|
| Flash_Point: | 148.2±13.9 °C |
| Melting_Point: | 126ºC |
| FW: | 191.183 |
| Density: | 1.2±0.1 g/cm3 |
| CAS: | 25978-74-9 |
| Bolling_Point: | 339.7±27.0 °C at 760 mmHg |
| MF: | C10H9NO3 |
| Molecular_Structure: | ['1 . Molar refractive index 4879 ', '2 . Molar volume （m3/mol）1584 ', '3 . Parachor （902K）4154 ', '4 . Surface tension 472 ', '5 . Polarizability （10 -24cm 3）1934'] |
|---|---|
| Flash_Point: | 148.2±13.9 °C |
| Refractive_Index: | 1.528 |
| FW: | 191.183 |
| Density: | 1.2±0.1 g/cm3 |
| Bolling_Point: | 339.7±27.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :15 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 593 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :255 ', '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'] |
| LogP: | 2.19 |
| Melting_Point: | 126ºC |
| PSA: | 59.32000 |
| MF: | C10H9NO3 |
| More_Info: | ['1 . Appearance 浅棕色Solid ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kpa,20ºC）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'] |
| Vapor_Pressure: | 0.0±0.7 mmHg at 25°C |
| Exact_Mass: | 191.058243 |
| Hazard_Codes: | Xn:Harmful; |
|---|---|
| Risk_Statements(EU): | R20/22 |
| Packing_Group: | III |
| Hazard_Class: | 6.1 |
| RIDADR: | UN 3439 |
| HS_Code: | 2926909090 |
| Safety_Statements: | S22-S36/37 |
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