| CAS Number | 1261776-23-1 |
| Catalog Number | AG01ABR0(AGN-PC-0WCC21) |
| Chemical Name | 4-Chloro-2-(difluoromethoxy)-1-nitrobenzene |
| IUPAC Name | 4-chloro-2-(difluoromethoxy)-1-nitrobenzene |
| InChI | InChI=1S/C7H4ClF2NO3/c8-4-1-2-5(11(12)13)6(3-4)14-7(9)10/h1-3,7H |
| InChI Key | FVGQBSQDQICCHZ-UHFFFAOYSA-N |
| MDL Number | MFCD18392675 |
| Molecular Formula | C7H4ClF2NO3 |
| Molecular Weight | 223.5614 |
| SMILES | ClC1=CC(=C(C=C1)[N+](=O)[O-])OC(F)F |
| Synonyms | 4-chloro-2-(difluoromethoxy)-1-nitrobenzene,
1261776-23-1,
4-Chloro-2-(difluoromethoxy)-1-nitro-benzene,
SCHEMBL17410994,
ZINC84193143,
AKOS016016314,
NE59897,
4-Chloro-2-(difluoromethoxy)nitrobenzene,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.56g/mol |
| Monoisotopic Mass | 222.985g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number