1-Isocyanato-4-methoxy-2-nitrobenzene
Catalog No: FT-0679338
CAS No: 117162-85-3
- Chemical Name: 1-Isocyanato-4-methoxy-2-nitrobenzene
- Molecular Formula: C8H6N2O4
- Molecular Weight: 194.14
- InChI Key: FSQHKLWMIIFYNP-UHFFFAOYSA-N
- InChI: InChI=1S/C8H6N2O4/c1-14-6-2-3-7(9-5-11)8(4-6)10(12)13/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: | 194.14400 |
| Density: | 1.33g/cm3 |
| CAS: | 117162-85-3 |
| Bolling_Point: | 330.1ºC at 760 mmHg |
| Product_Name: | 1-Isocyanato-4-methoxy-2-nitrobenzene |
| Melting_Point: | 79-82ºC(lit.) |
| Flash_Point: | 153.4ºC |
| MF: | C8H6N2O4 |
| Molecular_Structure: | ['1. Molar refractive index 4763 ', '2. Molar volume 1458 ', '3. Parachor （902K）3909 ', '4. Surface tension 516 ', '5. Dielectric constant N/A ', '6. Polarizability 1888 ', '7. Single isotope mass 194032757 Da ', '8. Nominal mass 194 Da ', '9. Average mass 1941442 Da'] |
|---|---|
| Flash_Point: | 153.4ºC |
| Refractive_Index: | 1.566 |
| FW: | 194.14400 |
| Density: | 1.33g/cm3 |
| Bolling_Point: | 330.1ºC at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 845 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :257 ', '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: | 2.09390 |
| Melting_Point: | 79-82ºC(lit.) |
| PSA: | 84.48000 |
| MF: | C8H6N2O4 |
| More_Info: | ['1 . Appearance Solid ', '2 . Density（g/mL,25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）79-82 ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC，05mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（°F）Unknow ', '9 . Specific rotation（ºF）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,110ºC）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: | 0.00017mmHg at 25°C |
| Exact_Mass: | 194.03300 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Faceshields;Gloves |
|---|---|
| Hazard_Codes: | Xn: Harmful; |
| Risk_Statements(EU): | R20/21/22 |
| Safety_Statements: | S22 |
| Symbol: | Danger |
| Warning_Statement: | P261-P280-P305 + P351 + P338-P342 + P311 |
| RIDADR: | UN 3335 |
| HS_Code: | 2929109000 |
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