| CAS Number | 83189-99-5 |
| Catalog Number | AG00IDA3(AGN-PC-00M0LX) |
| Chemical Name | 1-(Difluoromethoxy)-2-fluoro-4-nitro-benzene |
| IUPAC Name | 1-(difluoromethoxy)-2-fluoro-4-nitrobenzene |
| InChI | InChI=1S/C7H4F3NO3/c8-5-3-4(11(12)13)1-2-6(5)14-7(9)10/h1-3,7H |
| InChI Key | GJLRUCVWLFOGHP-UHFFFAOYSA-N |
| MDL Number | MFCD05179490 |
| Molecular Formula | C7H4F3NO3 |
| Molecular Weight | 207.1068 |
| SMILES | FC(OC1=C(C=C(C=C1)[N+](=O)[O-])F)F |
| Synonyms | 83189-99-5,
1-(Difluoromethoxy)-2-fluoro-4-nitro-benzene,
4-(Difluoromethoxy)-3-fluoro-1-nitrobenzene,
1-(DIFLUOROMETHOXY)-2-FLUORO-4-NITROBENZENE,
SCHEMBL9526847,
0261AF,
MFCD14698453,
ZINC39596524,
4-Difluoromethoxy-3-fluoronitrobenzene,
AKOS016016325,
FCH1387109,
AS-46472,
PC501895,
C7H4F3NO3,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.108g/mol |
| Monoisotopic Mass | 207.014g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number