2-benzylsulfanyl-5-nitrobenzonitrile
Catalog No: FT-0703045
CAS No: 175135-67-8
- Chemical Name: 2-benzylsulfanyl-5-nitrobenzonitrile
- Molecular Formula: C14H10N2O2S
- Molecular Weight: 270.31
- InChI Key: UVENNUQTKADSQA-UHFFFAOYSA-N
- InChI: InChI=1S/C14H10N2O2S/c15-9-12-8-13(16(17)18)6-7-14(12)19-10-11-4-2-1-3-5-11/h1-8H,10H2
| 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 |
| Bolling_Point: | 438.6ºC at 760 mmHg |
|---|---|
| CAS: | 175135-67-8 |
| MF: | C14H10N2O2S |
| Density: | 1.33g/cm3 |
| Melting_Point: | N/A |
| Product_Name: | 2-benzylsulfanyl-5-nitrobenzonitrile |
| Flash_Point: | 219.1ºC |
| FW: | 270.30600 |
| MF: | C14H10N2O2S |
|---|---|
| Density: | 1.33g/cm3 |
| Computational_Chemistry: | ['1. XlogP :35 ', '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 949 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :354 ', '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'] |
| More_Info: | ['1 . Appearance 粉末 ', '2 . Density（g/mL, 20 ℃ ）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 4 mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）Unknow ', '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'] |
| Exact_Mass: | 270.04600 |
| Vapor_Pressure: | 6.82E-08mmHg at 25°C |
| Flash_Point: | 219.1ºC |
| PSA: | 94.91000 |
| LogP: | 4.28198 |
| Bolling_Point: | 438.6ºC at 760 mmHg |
| FW: | 270.30600 |
| Refractive_Index: | 1.66 |
| Hazard_Class: | 6.1 |
|---|---|
| HS_Code: | 2930909090 |
| Safety_Statements: | S22;S36/S37 |
| Packing_Group: | III |
| RIDADR: | UN 3276 |
| Risk_Statements(EU): | R20/21/22 |
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