2-Isopropylphenyl isocyanate
Catalog No: FT-0612697
CAS No: 56309-56-9
- Chemical Name: 2-Isopropylphenyl isocyanate
 - Molecular Formula: C10H11NO
 - Molecular Weight: 161.2
 - InChI Key: MWBSQVPLYJZPTG-UHFFFAOYSA-N
 - InChI: InChI=1S/C10H11NO/c1-8(2)9-5-3-4-6-10(9)11-7-12/h3-6,8H,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 | 
| Melting_Point: | N/A | 
|---|---|
| CAS: | 56309-56-9 | 
| MF: | C10H11NO | 
| Flash_Point: | 190 °F | 
| Product_Name: | 2-Isopropylphenyl isocyanate | 
| Density: | 1.019 g/mL at 25 °C(lit.) | 
| FW: | 161.20000 | 
| Bolling_Point: | 66-67 °C5 mm Hg(lit.) | 
| Refractive_Index: | n20/D 1.524(lit.) | 
|---|---|
| Flash_Point: | 190 °F | 
| LogP: | 2.77730 | 
| Bolling_Point: | 66-67 °C5 mm Hg(lit.) | 
| FW: | 161.20000 | 
| PSA: | 29.43000 | 
| Computational_Chemistry: | ['1. XlogP :38 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 294 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :182 ', '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'] | 
| MF: | C10H11NO | 
| Exact_Mass: | 161.08400 | 
| Molecular_Structure: | ['1 . Molar refractive index 4961 ', '2 . Molar volume 1651 ', '3 . Parachor (902K)3960 ', '4 . Surface tension 330 ', '5 . Polarizability 1966 ', '6 . Dielectric constant 未确定'] | 
| Density: | 1.019 g/mL at 25 °C(lit.) | 
| More_Info: | ['1 . Appearance 无可用 ', '2 . Density(g/mL,25/4℃)1019 ', ' 3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)无可用 ', '5 . Boiling point(ºC,Atmospheric pressure)66-67/5mmHg ', '6 . Boiling point(ºC,52kPa)无可用 ', '7 . Refractive index1524 ', '8 . Flash point(ºC)88 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V)无可用 ', '19 . Solubility 无可用'] | 
| Hazard_Class: | 6.1 | 
|---|---|
| Risk_Statements(EU): | R20/21/22;R36/37/38 | 
| WGK_Germany: | 3 | 
| RIDADR: | UN 2206 6.1/PG 3 | 
| Hazard_Codes: | Xn:Harmful; | 
| HS_Code: | 2929109000 | 
| Safety_Statements: | S23-S26-S36 | 
| Packing_Group: | III | 
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