4-TERT-BUTYLPHENYL ISOTHIOCYANATE
Catalog No: FT-0619512
CAS No: 19241-24-8
- Chemical Name: 4-TERT-BUTYLPHENYL ISOTHIOCYANATE
- Molecular Formula: C11H13NS
- Molecular Weight: 191.29
- InChI Key: OCGNNCBNRBTUCG-UHFFFAOYSA-N
- InChI: InChI=1S/C11H13NS/c1-11(2,3)9-4-6-10(7-5-9)12-8-13/h4-7H,1-3H3
| 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: | 42 °C |
|---|---|
| CAS: | 19241-24-8 |
| MF: | C11H13NS |
| Flash_Point: | 122.8ºC |
| Product_Name: | 4-tert-Butylphenyl isothiocyanate |
| Density: | 0.96 g/cm3 |
| FW: | 191.29300 |
| Bolling_Point: | 92 °C |
| Refractive_Index: | 1.531 |
|---|---|
| Vapor_Pressure: | 0.0084mmHg at 25°C |
| Flash_Point: | 122.8ºC |
| LogP: | 3.71840 |
| Bolling_Point: | 92 °C |
| FW: | 191.29300 |
| PSA: | 44.45000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '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 444 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :203 ', '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'] |
| Melting_Point: | 42 °C |
| MF: | C11H13NS |
| Exact_Mass: | 191.07700 |
| Molecular_Structure: | ['1 . Molar refractive index 6104 ', '2 . Molar volume (m3/mol)1972 ', '3 . Parachor (902K)4651 ', '4 . Surface tension 309 ', '5 . Polarizability 2420'] |
| Density: | 0.96 g/cm3 |
| More_Info: | ['1 . Appearance 不确定 ', '2 . Density(g/mL,25/4℃)不确定 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting point(ºC)42 ', '5 . Boiling point(ºC,Atmospheric pressure)92 ', '6 . Boiling point(ºC, 52kPa)不确定 ', '7 . Refractive index不确定 ', '8 . Flash point(ºC)不确定 ', '9 . Specific rotation(º)不确定 ', '10 . Spontaneous ignition point or ignition temperature(ºC)不确定 ', '11 . Vapor pressure(kPa,25ºC)不确定 ', '12 . Saturated vapor pressure(kPa,60ºC)不确定 ', '13 . Combustion heat(KJ/mol)不确定 ', '14 . Critical temperature(ºC)不确定 ', '15 . Critical pressure(KPa)不确定 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion(%,V/V)不确定 ', '18 . Lower limit of explosion(%,V/V)不确定 ', '19 . Solubility 不确定'] |
| RIDADR: | 2811 |
|---|---|
| Hazard_Codes: | T: Toxic; |
| HS_Code: | 2930909090 |
| Risk_Statements(EU): | R20/21/22 |
| Safety_Statements: | S26-S36/37/39 |
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