| CAS Number | 2138131-80-1 |
| Catalog Number | AG01EL8V |
| Chemical Name | methyl 2-amino-2-(3-bromophenyl)propanoate hydrochloride |
| IUPAC Name | methyl 2-amino-2-(3-bromophenyl)propanoate;hydrochloride |
| InChI | InChI=1S/C10H12BrNO2.ClH/c1-10(12,9(13)14-2)7-4-3-5-8(11)6-7;/h3-6H,12H2,1-2H3;1H |
| InChI Key | CJDRRDNWZIJGBA-UHFFFAOYSA-N |
| MDL Number | MFCD31381189 |
| Molecular Formula | C10H13BrClNO2 |
| Molecular Weight | 294.5727 |
| SMILES | Cl.COC(C(C1=CC(Br)=CC=C1)(N)C)=O |
| Synonyms | methyl 2-amino-2-(3-bromophenyl)propanoate hydrochloride,
2138131-80-1,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.982g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.573g/mol |
| Monoisotopic Mass | 292.982g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number