Benzyl (S)-(-)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate p-toluenesulfonic acid salt
Catalog No: FT-0654128
CAS No: 77497-97-3
- Chemical Name: Benzyl (S)-(-)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate p-toluenesulfonic acid salt
- Molecular Formula: C24H25NO5S
- Molecular Weight: 439.5
- InChI Key: PSMBIFNNFMRIMV-NTISSMGPSA-N
- InChI: InChI=1S/C17H17NO2.C7H8O3S/c19-17(20-12-13-6-2-1-3-7-13)16-10-14-8-4-5-9-15(14)11-18-16;1-6-2-4-7(5-3-6)11(8,9)10/h1-9,16,18H,10-12H2;2-5H,1H3,(H,8,9,10)/t16-;/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 |
| Symbol: | |
|---|---|
| FW: | 439.524 |
| Density: | N/A |
| CAS: | 77497-97-3 |
| Bolling_Point: | 634.1ºC at 760 mmHg |
| Product_Name: | S-1,2,3,4-TETRAHYDRO-3-ISOQUINOLINE CARBOXYLIC ACID BENZYL ESTER P-TOLUENESULFONIC ACID SALT |
| Melting_Point: | 145-150°C |
| Flash_Point: | N/A |
| MF: | C24H25NO5S |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 101 ', '7. Heavy Atom Count :31 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :617 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :2 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :2'] |
|---|---|
| LogP: | 5.09560 |
| Melting_Point: | 145-150°C |
| FW: | 439.524 |
| PSA: | 101.08000 |
| MF: | C24H25NO5S |
| More_Info: | ['1 . Appearance 。 ', '2 . Density(g/mL,25/4℃) ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC) ', '5 . Boiling point(ºC,Atmospheric pressure) ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '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 Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility 。'] |
| Bolling_Point: | 634.1ºC at 760 mmHg |
| Exact_Mass: | 439.145355 |
| Personal_Protective_Equipment: | Eyeshields;Gloves |
|---|---|
| Hazard_Codes: | N:Dangerousfortheenvironment; |
| Risk_Statements(EU): | R51/53 |
| Safety_Statements: | S61 |
| Symbol: | GHS09 |
| Warning_Statement: | P273 |
| RIDADR: | UN 3077 |
| HS_Code: | 2933499090 |
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