![6-[[(4-methylphenyl)sulphonyl]amino]hexanoic acid Structure](https://www.chemicalbook.com/CAS/GIF/78521-39-8.gif)
6-[[(4-methylphenyl)sulphonyl]amino]hexanoic acid
- Product Name6-[[(4-methylphenyl)sulphonyl]amino]hexanoic acid
- CAS78521-39-8
- CBNumberCB3890338
- MFC13H19NO4S
- MW285.36
- EINECS278-934-5
- MDL NumberMFCD00177935
- MOL File78521-39-8.mol
Chemical Properties
| Melting point: | 106-108 °C |
| Boiling point: | 475.2±55.0 °C(Predicted) |
| Density | 1.175[at 20℃] |
| vapor pressure | 0Pa at 20℃ |
| storage temp. | 2-8°C |
| pka | 4.44[at 20 ℃] |
| Water Solubility | 317mg/L at 25℃ |
| InChI | InChI=1S/C13H19NO4S/c1-11-6-8-12(9-7-11)19(17,18)14-10-4-2-3-5-13(15)16/h6-9,14H,2-5,10H2,1H3,(H,15,16) |
| InChIKey | GLKZGJGPYOFPKV-UHFFFAOYSA-N |
| SMILES | C(O)(=O)CCCCCNS(C1=CC=C(C)C=C1)(=O)=O |
| LogP | 1.96 at 20℃ |
| EPA Substance Registry System | Hexanoic acid, 6-[[(4-methylphenyl)sulfonyl]amino]- (78521-39-8) |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H302-H315-H319-H335 |
| Precautionary statements | P280-P305+P351+P338 |
| TSCA | TSCA listed |
| HS Code | 2935900090 |
| REACH Registrations | Active |