N-Ethyl-N-benzylaniline-3'-sulfonic acid
Catalog No: FT-0631532
CAS No: 101-11-1
- Chemical Name: N-Ethyl-N-benzylaniline-3'-sulfonic acid
- Molecular Formula: C15H17NO3S
- Molecular Weight: 291.4
- InChI Key: BQGRVFPPZJPWPB-UHFFFAOYSA-N
- InChI: InChI=1S/C15H17NO3S/c1-2-16(14-8-4-3-5-9-14)12-13-7-6-10-15(11-13)20(17,18)19/h3-11H,2,12H2,1H3,(H,17,18,19)
| 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: | 3-((Ethyl(phenyl)amino)methyl)benzenesulfonic acid |
|---|---|
| Flash_Point: | N/A |
| Melting_Point: | N/A |
| FW: | 291.365 |
| Density: | 1.3±0.1 g/cm3 |
| CAS: | 101-11-1 |
| Bolling_Point: | N/A |
| MF: | C15H17NO3S |
| Density: | 1.3±0.1 g/cm3 |
|---|---|
| Computational_Chemistry: | ['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 66 ', '7. Heavy Atom Count :20 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :384 ', '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'] |
| Molecular_Structure: | ['1 . Molar refractive index 7958 ', '2 . Molar volume 2274 ', '3 . Parachor （902K）6188 ', '4 . Surface tension 548 ', '5 . Polarizability 3154'] |
| LogP: | 3.00 |
| Refractive_Index: | 1.617 |
| FW: | 291.365 |
| PSA: | 65.99000 |
| MF: | C15H17NO3S |
| More_Info: | ['1. Appearance White 粉末。'] |
| Exact_Mass: | 291.092926 |
| Hazard_Codes: | Xi |
|---|---|
| Risk_Statements(EU): | R36/37/38:Irritating to eyes, respiratory system and skin . |
| HS_Code: | 2921499090 |
| WGK_Germany: | 3 |
| Safety_Statements: | S26-S36 |
