| CAS Number | 1427428-42-9 |
| Catalog Number | AG01BJKE |
| Chemical Name | 4-bromo-5-fluoro-1,3-dioxaindane |
| IUPAC Name | 4-bromo-5-fluoro-1,3-benzodioxole |
| InChI | InChI=1S/C7H4BrFO2/c8-6-4(9)1-2-5-7(6)11-3-10-5/h1-2H,3H2 |
| InChI Key | OHUWAUIJHDBDIT-UHFFFAOYSA-N |
| MDL Number | MFCD23709713 |
| Molecular Formula | C7H4BrFO2 |
| Molecular Weight | 219.0079 |
| SMILES | FC1=C(Br)C2=C(OCO2)C=C1 |
| Synonyms | 1427428-42-9,
MFCD23709713,
AKOS024089532,
4-bromo-5-fluoro-2-1,3-benzodioxole,
4-Bromo-5-fluoro-2H-1,3-benzodioxole,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.938g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.009g/mol |
| Monoisotopic Mass | 217.938g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number