SEC-BUTYL ISOTHIOCYANATE
Catalog No: FT-0635288
CAS No: 4426-79-3
- Chemical Name: SEC-BUTYL ISOTHIOCYANATE
- Molecular Formula: C5H9NS
- Molecular Weight: 115.2
- InChI Key: TUFJIDJGIQOYFY-UHFFFAOYSA-N
- InChI: InChI=1S/C5H9NS/c1-3-5(2)6-4-7/h5H,3H2,1-2H3
| 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: | 4426-79-3 |
| MF: | C5H9NS |
| Flash_Point: | 44.2ºC |
| Product_Name: | Isothiocyanic Acid Sec-Butyl Ester |
| Density: | 0.93 |
| FW: | 115.19700 |
| Bolling_Point: | 58 °C |
| Refractive_Index: | 1.485 |
|---|---|
| Flash_Point: | 44.2ºC |
| LogP: | 1.88770 |
| Bolling_Point: | 58 °C |
| FW: | 115.19700 |
| 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 :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :841 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| MF: | C5H9NS |
| Exact_Mass: | 115.04600 |
| Molecular_Structure: | ['1 . Molar refractive index 3559 ', '2 . Molar volume (m3/mol)1241 ', '3 . Parachor (902K)2809 ', '4 . Surface tension 261 ', '5 . Polarizability (10 -24cm 3)1411'] |
| Density: | 0.93 |
| More_Info: | ['1 . Appearance Colourless 透明to Yellow Liquid ', '2 . Density(g/mL)0955 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting point(ºC)不确定 ', '5 . Boiling point(ºC)70-71 ', '6 . Boiling point(ºC,05mmHg)不确定 ', '7 . Refractive index1499-1501 ', '8 . Flash point(ºC)66 ', '9 . Specific rotation(º)不确定 ', '10 . Spontaneous ignition point or ignition temperature(ºC)不确定 ', '11 蒸汽压(20ºC)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: | 2927 |
|---|---|
| Risk_Statements(EU): | R23/24/25 |
| HS_Code: | 2930909090 |
| Safety_Statements: | S26-S27-S38 |
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