1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID
Catalog No: FT-0605854
CAS No: 129271-98-3
- Chemical Name: 1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID
- Molecular Formula: C14H12BNO4S
- Molecular Weight: 301.1
- InChI Key: YKTZLHLBQGCFQX-UHFFFAOYSA-N
- InChI: InChI=1S/C14H12BNO4S/c17-15(18)13-10-16(14-9-5-4-8-12(13)14)21(19,20)11-6-2-1-3-7-11/h1-10,17-18H
| 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 |
| Product_Name: | 1-Benzenesulfonyl-1H-indole-3-boronic acid |
|---|---|
| Flash_Point: | 305.41ºC |
| Melting_Point: | 144 °C (dec.)(lit.) |
| FW: | 301.12500 |
| Density: | 1.35g/cm3 |
| CAS: | 129271-98-3 |
| Bolling_Point: | 581.384ºC at 760 mmHg |
| MF: | C14H12BNO4S |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 7966 ', '2 . Molar volume 2230 ', '3 . Parachor （902K）6094 ', '4 . Surface tension 557 ', '5 . Polarizability 158'] |
|---|---|
| LogP: | 1.63890 |
| Flash_Point: | 305.41ºC |
| Refractive_Index: | 1.633 |
| FW: | 301.12500 |
| Density: | 1.35g/cm3 |
| Bolling_Point: | 581.384ºC at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 879 ', '7. Heavy Atom Count :21 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :458 ', '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: | 144 °C (dec.)(lit.) |
| PSA: | 87.91000 |
| MF: | C14H12BNO4S |
| Vapor_Pressure: | 0mmHg at 25°C |
| Exact_Mass: | 301.05800 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard_Codes: | Xi |
| Risk_Statements(EU): | R36/37/38 |
| RIDADR: | NONH for all modes of transport |
| HS_Code: | 2933990090 |
| WGK_Germany: | 3 |
| Safety_Statements: | S24/25 |
