| CAS Number | 497060-37-4 |
| Catalog Number | AG00IVC3(AGN-PC-0WB24L) |
| Chemical Name | 2,5-Dichloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzene-1-sulfonamide |
| IUPAC Name | 2,5-dichloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzenesulfonamide |
| InChI | InChI=1S/C13H7Cl2F4NO2S/c14-7-1-3-10(15)12(5-7)23(21,22)20-8-2-4-11(16)9(6-8)13(17,18)19/h1-6,20H |
| InChI Key | BWODEJGTGMVRPC-UHFFFAOYSA-N |
| MDL Number | MFCD01859659 |
| Molecular Formula | C13H7Cl2F4NO2S |
| Molecular Weight | 388.1648 |
| SMILES | ClC2(=C(S(=O)(=O)NC1(=CC(=C(F)C=C1)C(F)(F)F))C=C(Cl)C=C2) |
| Synonyms | 497060-37-4,
((2,5-DICHLOROPHENYL)SULFONYL)(4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL)AMINE,
2,5-dichloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzene-1-sulfonamide,
AC1MVGFS,
CTK6G8812,
ZINC2385479,
2,5-dichloro-N-[4-fluoro-3-(trifluoromethyl)phenyl]benzenesulfonamide,
MFCD01859659,
AKOS022169533,
MS-8050,
KS-000029E0,
CID3707442,
|
| Complexity | 511 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 386.951g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 388.158g/mol |
| Monoisotopic Mass | 386.951g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number