| CAS Number | 1042555-41-8 |
| Catalog Number | AG01AGW4 |
| Chemical Name | N-(3-hydroxyphenyl)propane-1-sulfonamide |
| IUPAC Name | N-(3-hydroxyphenyl)propane-1-sulfonamide |
| InChI | InChI=1S/C9H13NO3S/c1-2-6-14(12,13)10-8-4-3-5-9(11)7-8/h3-5,7,10-11H,2,6H2,1H3 |
| InChI Key | LVWXZUGNWJJKGS-UHFFFAOYSA-N |
| MDL Number | MFCD11167788 |
| Molecular Formula | C9H13NO3S |
| Molecular Weight | 215.2694 |
| SMILES | CCCS(NC1=CC(O)=CC=C1)(=O)=O |
| Synonyms | N-(3-hydroxyphenyl)propane-1-sulfonamide,
1042555-41-8,
AC1Q2YJJ,
ZINC20212975,
AKOS008010284,
MCULE-5663985110,
NE23912,
EN300-73029,
Z45637550,
|
| Complexity | 258 |
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.267g/mol |
| Monoisotopic Mass | 215.062g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 74.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number