| CAS Number | 554438-62-9 |
| Catalog Number | AG019HVW |
| Chemical Name | 4-fluoro-N-(4-hydroxyphenyl)-N-methylbenzene-1-sulfonamide |
| IUPAC Name | 4-fluoro-N-(4-hydroxyphenyl)-N-methylbenzenesulfonamide |
| InChI | InChI=1S/C13H12FNO3S/c1-15(11-4-6-12(16)7-5-11)19(17,18)13-8-2-10(14)3-9-13/h2-9,16H,1H3 |
| InChI Key | MYHFYWWLDZWBCQ-UHFFFAOYSA-N |
| MDL Number | MFCD03987990 |
| Molecular Formula | C13H12FNO3S |
| Molecular Weight | 281.3027 |
| SMILES | CN(S(C1=CC=C(F)C=C1)(=O)=O)C1=CC=C(O)C=C1 |
| Synonyms | 4-fluoro-N-(4-hydroxyphenyl)-N-methylbenzene-1-sulfonamide,
554438-62-9,
4-Fluoro-N-(4-hydroxy-phenyl)-N-methyl-benzenesulfonamide,
AC1M6YPI,
AC1Q3X3K,
CTK7J9371,
ZINC3316878,
AKOS000117200,
MCULE-6866809354,
NE26579,
EN300-04862,
Z56921129,
4-fluoro-N-(4-hydroxyphenyl)-N-methylbenzenesulfonamide,
4-fluoro-N-(4-hydroxyphenyl)-N-Methylbenzene-1-sulfonamide, AldrichCPR,
ZINC03316878,
CID2432620,
|
| Complexity | 379 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.301g/mol |
| Monoisotopic Mass | 281.052g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number