Ketanserin
Catalog No: FT-0630827
CAS No: 74050-98-9
- Molecular Formula: 395.4
- Formula Weight: C22H22FN3O3
- Inchl Key: FPCCSQOGAWCVBH-UHFFFAOYSA-N
- Inchl: InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)
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: | 227-235°C |
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CAS: | 74050-98-9 |
MF: | C22H22FN3O3 |
Flash_Point: | N/A |
Product_Name: | Ketanserin |
Density: | 1.3±0.1 g/cm3 |
FW: | 395.427 |
Bolling_Point: | N/A |
Refractive_Index: | 1.593 |
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LogP: | 3.21 |
FW: | 395.427 |
PSA: | 75.17000 |
Computational_Chemistry: | ['1. XlogP :26 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :10 ', '6. TPSA 697 ', '7. Heavy Atom Count :29 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :627 ', '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: | 227-235°C |
MF: | C22H22FN3O3 |
Exact_Mass: | 395.164520 |
Molecular_Structure: | ['1 . Molar refractive index 10459 ', '2 . Molar volume 3086 ', '3 . Parachor (902K)8191 ', '4 . Surface tension 495 ', '5 . Polarizability 4146'] |
Density: | 1.3±0.1 g/cm3 |
More_Info: | ['1. Appearance 从4-甲基-2-戊酮结晶。 ', '2. Melting point(℃)227-235。 ', '3溶解度(g/100ml)Water 0001, Ethanol 0038,二甲基甲酰胺234。 ', '4pKa 75。'] |
RTECS: | VA1411190 |
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HS_Code: | 2933990090 |
WGK_Germany: | 3 |