

2-BROMO-4-METHYLPHENYL ISOTHIOCYANATE
Catalog No: FT-0611463
CAS No: 19241-39-5
- Molecular Formula: 228.11
- Formula Weight: C8H6BrNS
- Inchl Key: DQXSCOWMTPPFCJ-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H6BrNS/c1-6-2-3-8(10-5-11)7(9)4-6/h2-4H,1H3
Assay | Pack | 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: | 19241-39-5 |
MF: | C8H6BrNS |
Flash_Point: | 119-120°C/0.5mm |
Product_Name: | 2-bromo-1-isothiocyanato-4-methylbenzene |
Density: | 1.52 |
FW: | 228.10900 |
Bolling_Point: | 120 °C |
Refractive_Index: | 1.6680 |
---|---|
Vapor_Pressure: | 0.00146mmHg at 25°C |
Flash_Point: | 119-120°C/0.5mm |
LogP: | 3.49180 |
Bolling_Point: | 120 °C |
FW: | 228.10900 |
PSA: | 44.45000 |
Computational_Chemistry: | ['1. XlogP :44 ', '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 444 ', '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'] |
MF: | C8H6BrNS |
Exact_Mass: | 226.94000 |
Molecular_Structure: | ['1 . Molar refractive index 5461 ', '2 . Molar volume (m3/mol)1577 ', '3 . Parachor (902K)3930 ', '4 . Surface tension 384 ', '5 . Polarizability 2165'] |
Density: | 1.52 |
More_Info: | ['1 . Appearance 不确定 ', '2 . Density(g/mL,25/4℃)152 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting point(ºC)不确定 ', '5 . Boiling point(ºC,Atmospheric pressure)120 ', '6 . Boiling point(ºC, 52kPa)不确定 ', '7 . Refractive index16680 ', '8 . Flash point(ºC)119 -120°C / 05mm ', '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'] |
Hazard_Class: | 6.1 |
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Risk_Statements(EU): | R20/21/22;R36/37/38 |
RIDADR: | 2810 |
Safety_Statements: | S26-S36/37/39 |
HS_Code: | 2930909090 |
Packing_Group: | III |
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