| CAS Number | 1249671-35-9 |
| Catalog Number | AG01AMW7 |
| Chemical Name | methyl 2-(4-bromo-2-formylphenoxy)propanoate |
| IUPAC Name | methyl 2-(4-bromo-2-formylphenoxy)propanoate |
| InChI | InChI=1S/C11H11BrO4/c1-7(11(14)15-2)16-10-4-3-9(12)5-8(10)6-13/h3-7H,1-2H3 |
| InChI Key | ARMFTDSPYSFXGD-UHFFFAOYSA-N |
| MDL Number | MFCD16040493 |
| Molecular Formula | C11H11BrO4 |
| Molecular Weight | 287.1066 |
| SMILES | COC(C(OC1=C(C=O)C=C(Br)C=C1)C)=O |
| Synonyms | methyl 2-(4-bromo-2-formylphenoxy)propanoate,
1249671-35-9,
AKOS008948977,
|
| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 285.984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 287.109g/mol |
| Monoisotopic Mass | 285.984g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 52.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number