| CAS Number | 2092001-87-9 |
| Catalog Number | AG01EHCG |
| Chemical Name | 2-(2,3-Difluoro-6-nitrophenyl)acetamide |
| IUPAC Name | 2-(2,3-difluoro-6-nitrophenyl)acetamide |
| InChI | InChI=1S/C8H6F2N2O3/c9-5-1-2-6(12(14)15)4(8(5)10)3-7(11)13/h1-2H,3H2,(H2,11,13) |
| InChI Key | JLFPNYIUBDKLJR-UHFFFAOYSA-N |
| MDL Number | MFCD30726942 |
| Molecular Formula | C8H6F2N2O3 |
| Molecular Weight | 216.1416 |
| SMILES | NC(=O)Cc1c(ccc(c1F)F)[N+](=O)[O-] |
| Synonyms | 2-(2,3-Difluoro-6-nitrophenyl)acetamide,
2092001-87-9,
|
| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.144g/mol |
| Monoisotopic Mass | 216.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 88.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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