| CAS Number | 1507484-63-0 |
| Catalog Number | AG01ELH7 |
| Chemical Name | 2-amino-5-bromo-3-ethoxybenzoic acid |
| IUPAC Name | 2-amino-5-bromo-3-ethoxybenzoic acid |
| InChI | InChI=1S/C9H10BrNO3/c1-2-14-7-4-5(10)3-6(8(7)11)9(12)13/h3-4H,2,11H2,1H3,(H,12,13) |
| InChI Key | NBFPJJDFDLREKN-UHFFFAOYSA-N |
| MDL Number | MFCD24033903 |
| Molecular Formula | C9H10BrNO3 |
| Molecular Weight | 260.0846 |
| SMILES | CCOC1=C(N)C(C(O)=O)=CC(Br)=C1 |
| Synonyms | 2-amino-5-bromo-3-ethoxybenzoic acid,
AKOS019609704,
1507484-63-0,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.087g/mol |
| Monoisotopic Mass | 258.984g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 72.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number