| CAS Number | 195136-63-1 |
| Catalog Number | AG00ADK6(AGN-PC-0N8B1F) |
| Chemical Name | 1,3-Difluoro-2,4-dimethoxy-5-nitrobenzene |
| IUPAC Name | 1,3-difluoro-2,4-dimethoxy-5-nitrobenzene |
| InChI | InChI=1S/C8H7F2NO4/c1-14-7-4(9)3-5(11(12)13)8(15-2)6(7)10/h3H,1-2H3 |
| InChI Key | RGBATJZGSLPNJM-UHFFFAOYSA-N |
| MDL Number | MFCD12547866 |
| Molecular Formula | C8H7F2NO4 |
| Molecular Weight | 219.1423 |
| SMILES | FC1=C(C(=C(C(=C1)[N+](=O)[O-])OC)F)OC |
| Synonyms | 1,3-difluoro-2,4-dimethoxy-5-nitrobenzene,
195136-63-1,
3,5-Difluoro-2,4-dimethoxynitrobenzene,
SCHEMBL6370869,
RGBATJZGSLPNJM-UHFFFAOYSA-N,
BBL103996,
STL557806,
ZINC39149927,
AKOS027385813,
CID10656475,
1,3-difluoro-2,4-dimethoxy-5-nitro-benzene,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.144g/mol |
| Monoisotopic Mass | 219.034g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number