| CAS Number | 876555-60-1 |
| Catalog Number | AG019EKQ |
| Chemical Name | N-(5-Fluoro-2-methylphenyl)-4-methylbenzenesulfonamide |
| IUPAC Name | N-(5-fluoro-2-methylphenyl)-4-methylbenzenesulfonamide |
| InChI | InChI=1S/C14H14FNO2S/c1-10-3-7-13(8-4-10)19(17,18)16-14-9-12(15)6-5-11(14)2/h3-9,16H,1-2H3 |
| InChI Key | NRKWVCRSYIKOGV-UHFFFAOYSA-N |
| MDL Number | MFCD05139663 |
| Molecular Formula | C14H14FNO2S |
| Molecular Weight | 279.3299 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C)C=CC(=C2)F |
| Synonyms | N-(5-fluoro-2-methylphenyl)-4-methylbenzenesulfonamide,
876555-60-1,
AC1N0DTH,
ZINC6316529,
STK411360,
AKOS001271128,
MCULE-4703219385,
CS-0061311,
ST50939493,
N-(5-Fluoro-2-methylphenyl)-4-methyl-benzenesulfonamide,
(5-fluoro-2-methylphenyl)[(4-methylphenyl)sulfonyl]amine,
ZINC06316529,
CID3936207,
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| Complexity | 385 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.329g/mol |
| Monoisotopic Mass | 279.073g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number