| CAS Number | 1037082-67-9 |
| Catalog Number | AG01ELG1 |
| Chemical Name | 1-Bromo-3,5-dimethoxy-4-iodobenzene |
| IUPAC Name | 5-bromo-2-iodo-1,3-dimethoxybenzene |
| InChI | InChI=1S/C8H8BrIO2/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3 |
| InChI Key | CNNQHSHLKMVLHZ-UHFFFAOYSA-N |
| MDL Number | MFCD28738448 |
| Molecular Formula | C8H8BrIO2 |
| Molecular Weight | 342.9564 |
| SMILES | COC1=C(I)C(OC)=CC(Br)=C1 |
| Synonyms | 1-Bromo-3,5-dimethoxy-4-iodobenzene,
1037082-67-9,
SCHEMBL8158740,
5-bromo-2-iodo-1,3-dimethoxybenzene,
ZINC166626463,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 341.875g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 342.958g/mol |
| Monoisotopic Mass | 341.875g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number