| CAS Number | 953717-92-5 |
| Catalog Number | AG003IXS(AGN-PC-0WCY59) |
| Chemical Name | 3-Amino-N-(4-fluorophenyl)benzenesulfonamide |
| IUPAC Name | 3-amino-N-(4-fluorophenyl)benzenesulfonamide |
| InChI | InChI=1S/C12H11FN2O2S/c13-9-4-6-11(7-5-9)15-18(16,17)12-3-1-2-10(14)8-12/h1-8,15H,14H2 |
| InChI Key | GEAAWZUJFWTHQJ-UHFFFAOYSA-N |
| MDL Number | MFCD09731646 |
| Molecular Formula | C12H11FN2O2S |
| Molecular Weight | 266.2913 |
| SMILES | Fc1ccc(cc1)NS(=O)(=O)c1cccc(c1)N |
| Synonyms | 3-AMINO-N-(4-FLUOROPHENYL)BENZENESULFONAMIDE,
953717-92-5,
ACMC-209ryk,
CTK5H7673,
DTXSID10588460,
ANW-40506,
MFCD09731646,
ZINC22173098,
AKOS000140064,
RTR-029776,
CJ-17353,
TR-029776,
V9605,
B-5289,
3-Amino-N-(4-fluorophenyl)benzene-1-sulfonamide,
I01-11803,
C12H11FN2O2S,
3-AMINO-N- BENZENESULFONAMIDE,
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| Complexity | 361 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.29g/mol |
| Monoisotopic Mass | 266.053g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number