| CAS Number | 1261606-77-2 |
| Catalog Number | AG01A1WW |
| Chemical Name | 1-(Difluoromethoxy)-3-fluoro-2-iodobenzene |
| IUPAC Name | 1-(difluoromethoxy)-3-fluoro-2-iodobenzene |
| InChI | InChI=1S/C7H4F3IO/c8-4-2-1-3-5(6(4)11)12-7(9)10/h1-3,7H |
| InChI Key | RTWSFJOKPIOUAM-UHFFFAOYSA-N |
| MDL Number | MFCD18396809 |
| Molecular Formula | C7H4F3IO |
| Molecular Weight | 288.0057 |
| SMILES | C=1(C(=C(C=CC1)F)I)OC(F)F |
| Synonyms | 1-(difluoromethoxy)-3-fluoro-2-iodobenzene,
1261606-77-2,
MFCD18396809,
ZINC82164461,
NE46461,
2-Fluoro-6-(difluoromethoxy)iodobenzene,
AS-48078,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 287.926g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 288.008g/mol |
| Monoisotopic Mass | 287.926g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number