| CAS Number | 1135-01-9 |
| Catalog Number | AG0093U4(AGN-PC-03IJZL) |
| Chemical Name | 4-Propoxybenzene-1-sulfonamide |
| IUPAC Name | 4-propoxybenzenesulfonamide |
| InChI | InChI=1S/C9H13NO3S/c1-2-7-13-8-3-5-9(6-4-8)14(10,11)12/h3-6H,2,7H2,1H3,(H2,10,11,12) |
| InChI Key | GWLVKQMJYAXAFM-UHFFFAOYSA-N |
| MDL Number | MFCD00460574 |
| Molecular Formula | C9H13NO3S |
| Molecular Weight | 215.2694 |
| SMILES | CCCOC1=CC=C(S(N)(=O)=O)C=C1 |
| Synonyms | 4-propoxybenzenesulfonamide,
4-propoxybenzene-1-sulfonamide,
1135-01-9,
CHEMBL3402959,
Benzenesulfonamide, 4-propoxy-,
SCHEMBL5595956,
BDBM50066134,
ZINC37023814,
AKOS005140236,
MCULE-9113395574,
NE19113,
DB-060520,
FT-0720501,
ST51069195,
Z371324110,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.267g/mol |
| Monoisotopic Mass | 215.062g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 77.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number