94594-81-7
Catalog No: FT-0701706
CAS No: 94594-81-7
- Chemical Name: 94594-81-7
- Molecular Formula: C14H21NO3S
- Molecular Weight: 283.39
- InChI Key: BKPQKSSKLBTRJO-LHNOPMQHSA-N
- InChI: InChI=1S/C14H21NO3S/c1-4-5-12(16)15-11-8-10-6-7-14(11,13(10,2)3)9-19(15,17)18/h4-5,10-11H,6-9H2,1-3H3/b5-4+/t10-,11-,14-/m0/s1
| 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 |
| Bolling_Point: | 397.2ºC at 760mmHg |
|---|---|
| CAS: | 94594-81-7 |
| MF: | C14H21NO3S |
| Density: | 1.27g/cm3 |
| Melting_Point: | 182-185ºC(lit.) |
| Product_Name: | (N-Crotonyl)-(2S)-bornane-10,2-sultam |
| Flash_Point: | 194ºC |
| FW: | 283.38600 |
| MF: | C14H21NO3S |
|---|---|
| Density: | 1.27g/cm3 |
| Computational_Chemistry: | ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 628 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :558 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :3 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :1 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| More_Info: | ['1 . Appearance Solid ', '2 . Density(g/mL 25ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºCAtmospheric pressure)182-185 ', '5 . Boiling point(ºC,19mmHg)Unknow ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC,)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)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 (25℃)Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility (mg/mL) Unknow'] |
| Exact_Mass: | 283.12400 |
| Flash_Point: | 194ºC |
| PSA: | 62.83000 |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 7343 ', '2 . Molar volume (m3/mol)2217 ', '3 . Parachor (902K)5895 ', '4 . Surface tension 499 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 2911'] |
| LogP: | 2.94810 |
| Bolling_Point: | 397.2ºC at 760mmHg |
| FW: | 283.38600 |
| Refractive_Index: | 1.576 |
| Melting_Point: | 182-185ºC(lit.) |
| Hazard_Codes: | Xi: Irritant; |
|---|---|
| HS_Code: | 2934999090 |
| Risk_Statements(EU): | R36/37/38 |
| Safety_Statements: | 26-36 |
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