1-Bromo-4-isocyanato-2-methylbenzene
Catalog No: FT-0679337
CAS No: 1591-97-5
- Chemical Name: 1-Bromo-4-isocyanato-2-methylbenzene
- Molecular Formula: C8H6BrNO
- Molecular Weight: 212.04
- InChI Key: AYFMPMKATOGAGY-UHFFFAOYSA-N
- InChI: InChI=1S/C8H6BrNO/c1-6-4-7(10-5-11)2-3-8(6)9/h2-4H,1H3
| 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: | Danger |
|---|---|
| FW: | 212.04300 |
| Density: | 1.507 g/mL at 25ºC(lit.) |
| CAS: | 1591-97-5 |
| Bolling_Point: | 245ºC(lit.) |
| Product_Name: | 1-Bromo-4-isocyanato-2-methylbenzene |
| Melting_Point: | N/A |
| Flash_Point: | >230 °F |
| MF: | C8H6BrNO |
| LogP: | 2.72480 |
|---|---|
| Flash_Point: | >230 °F |
| Refractive_Index: | n20/D 1.584(lit.) |
| FW: | 212.04300 |
| Density: | 1.507 g/mL at 25ºC(lit.) |
| Bolling_Point: | 245ºC(lit.) |
| Computational_Chemistry: | ['1. XlogP :38 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 294 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :177 ', '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'] |
| PSA: | 29.43000 |
| MF: | C8H6BrNO |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/mL,15℃）1507 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）245 ', '6 . Refractive index1584 ', '7 . Flash point（ºC）110 ', '8 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '9 . Specific rotation（º） Unknow ', '10 . Vapor pressure（kPa,25ºC）Unknow ', '11 . Saturated vapor pressure（kPa,60ºC）Unknow ', '12 . Combustion heat（KJ/mol）Unknow ', '13 . Critical temperature（ºC）Unknow ', '14 . Critical pressure（KPa）Unknow ', '15 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '16 . Upper limit of explosion（%,V/V）Unknow ', '17 . Lower limit of explosion（%,V/V）Unknow ', '18 . Solubility Unknow'] |
| Vapor_Pressure: | 0.0094mmHg at 25°C |
| Exact_Mass: | 210.96300 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
|---|---|
| Hazard_Codes: | Xn |
| Risk_Statements(EU): | R20/21/22 |
| Safety_Statements: | S23 |
| Symbol: | Danger |
| Warning_Statement: | P261-P280-P305 + P351 + P338-P342 + P311 |
| RIDADR: | UN 2206 6.1/PG 3 |
| HS_Code: | 2929109000 |
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