4-chloro-2-isocyanato-1-phenoxybenzene
Catalog No: FT-0717801
CAS No: 85385-33-7
- Chemical Name: 4-chloro-2-isocyanato-1-phenoxybenzene
- Molecular Formula: C13H8ClNO2
- Molecular Weight: 245.66 g/mol
- InChI Key: SCGXZJTXFUNGAL-UHFFFAOYSA-N
- InChI: InChI=1S/C13H8ClNO2/c14-10-6-7-13(12(8-10)15-9-16)17-11-4-2-1-3-5-11/h1-8H
| 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 |
| CAS: | 85385-33-7 |
|---|---|
| MF: | C13H8ClNO2 |
| Density: | 1.21g/cm3 |
| Flash_Point: | >230 °F |
| Melting_Point: | 43-47ºC(lit.) |
| Product_Name: | 4-chloro-2-isocyanato-1-phenoxybenzene |
| Symbol: | GHS07, GHS08 |
| Bolling_Point: | 335.4ºC at 760 mmHg |
| FW: | 245.66100 |
| MF: | C13H8ClNO2 |
|---|---|
| Density: | 1.21g/cm3 |
| Computational_Chemistry: | ['1. XlogP :49 ', '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 387 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :285 ', '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 Solid ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）43-47 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC, KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）>110 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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: | 245.02400 |
| Flash_Point: | >230 °F |
| PSA: | 38.66000 |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 6725 ', '2 . Molar volume （m3/mol）2026 ', '3 . Parachor （902K）5201 ', '4 . Surface tension 433 ', '5 . Dielectric constant N/A ', '6 偶极距（10 -24cm 3）N/A ', '7 . Polarizability 2666'] |
| LogP: | 4.09960 |
| Bolling_Point: | 335.4ºC at 760 mmHg |
| FW: | 245.66100 |
| Refractive_Index: | 1.577 |
| Melting_Point: | 43-47ºC(lit.) |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Faceshields;Gloves |
|---|---|
| Symbol: | GHS07, GHS08 |
| Safety_Statements: | 22-26-36 |
| Warning_Statement: | P261-P280-P305 + P351 + P338-P342 + P311 |
| Hazard_Codes: | Xn |
| HS_Code: | 2929109000 |
| RIDADR: | NONH for all modes of transport |
| Risk_Statements(EU): | 20/21/22-36/37/38-42 |
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