| CAS Number | 1306605-67-3 |
| Catalog Number | AG01AI46 |
| Chemical Name | 2-amino-2-(2-bromophenyl)propanoic acid hydrochloride |
| IUPAC Name | 2-amino-2-(2-bromophenyl)propanoic acid;hydrochloride |
| InChI | InChI=1S/C9H10BrNO2.ClH/c1-9(11,8(12)13)6-4-2-3-5-7(6)10;/h2-5H,11H2,1H3,(H,12,13);1H |
| InChI Key | LYYDUVHPUKPSPN-UHFFFAOYSA-N |
| MDL Number | MFCD18838828 |
| Molecular Formula | C9H11BrClNO2 |
| Molecular Weight | 280.5461 |
| SMILES | Cl.CC(C1=C(Br)C=CC=C1)(C(O)=O)N |
| Synonyms | 2-amino-2-(2-bromophenyl)propanoic acid hydrochloride,
1306605-67-3,
AKOS008108056,
MCULE-7188454632,
NE39217,
EN300-76700,
Z1259339920,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.966g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.546g/mol |
| Monoisotopic Mass | 278.966g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number