| CAS Number | 781574-33-2 |
| Catalog Number | AG01C1VV |
| Chemical Name | 2,4,6-Triethylbenzene-1-sulfonamide |
| IUPAC Name | 2,4,6-triethylbenzenesulfonamide |
| InChI | InChI=1S/C12H19NO2S/c1-4-9-7-10(5-2)12(16(13,14)15)11(6-3)8-9/h7-8H,4-6H2,1-3H3,(H2,13,14,15) |
| InChI Key | ZSXPCHZVLVJYPC-UHFFFAOYSA-N |
| MDL Number | MFCD24232469 |
| Molecular Formula | C12H19NO2S |
| Molecular Weight | 241.3498 |
| SMILES | CCC1=CC(CC)=C(S(N)(=O)=O)C(CC)=C1 |
| Synonyms | 2,4,6-triethylbenzene-1-sulfonamide,
781574-33-2,
SCHEMBL10871084,
ZINC59566074,
AKOS020740630,
Z2240989607,
|
| Complexity | 294 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.349g/mol |
| Monoisotopic Mass | 241.114g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number