| CAS Number | 796-69-0 |
| Catalog Number | AG0050XK(AGN-PC-00LMTV) |
| Chemical Name | Bis(4-fluoro-2-nitrophenyl) disulfide |
| IUPAC Name | 4-fluoro-1-[(4-fluoro-2-nitrophenyl)disulfanyl]-2-nitrobenzene |
| InChI | InChI=1S/C12H6F2N2O4S2/c13-7-1-3-11(9(5-7)15(17)18)21-22-12-4-2-8(14)6-10(12)16(19)20/h1-6H |
| InChI Key | ILHDUSONWGHVPO-UHFFFAOYSA-N |
| MDL Number | MFCD22375034 |
| Molecular Formula | C12H6F2N2O4S2 |
| Molecular Weight | 344.3138 |
| SMILES | Fc1ccc(c(c1)[N+](=O)[O-])SSc1ccc(cc1[N+](=O)[O-])F |
| Synonyms | Bis(4-fluoro-2-nitrophenyl) disulfide,
796-69-0,
Disulfide, bis(4-fluoro-2-nitrophenyl),
1,2-Bis(4-fluoro-2-nitrophenyl)disulfane,
ACMC-209phv,
C12H6F2N2O4S2,
CTK2G3955,
DTXSID20531063,
ANW-37313,
MFCD22375034,
ZINC85483131,
TC-126058,
V7804,
B-8435,
1,1'-Disulfanediylbis(4-fluoro-2-nitrobenzene),
4-FLUORO-1-[(4-FLUORO-2-NITROPHENYL)DISULFANYL]-2-NITROBENZENE,
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| Complexity | 383 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 343.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 344.307g/mol |
| Monoisotopic Mass | 343.974g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 142A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number