| CAS Number | 1955494-61-7 |
| Catalog Number | AG01B2JT |
| Chemical Name | 3-amino-2-hydroxy-2-methyl-3-phenylpropanoic acid hydrochloride |
| IUPAC Name | 3-amino-2-hydroxy-2-methyl-3-phenylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C10H13NO3.ClH/c1-10(14,9(12)13)8(11)7-5-3-2-4-6-7;/h2-6,8,14H,11H2,1H3,(H,12,13);1H |
| InChI Key | YDVMRRAGKZNWSN-UHFFFAOYSA-N |
| MDL Number | MFCD29991637 |
| Molecular Formula | C10H14ClNO3 |
| Molecular Weight | 231.6761 |
| SMILES | Cl.CC(C(O)=O)(C(C1=CC=CC=C1)N)O |
| Synonyms | 3-amino-2-hydroxy-2-methyl-3-phenylpropanoic acid hydrochloride,
1955494-61-7,
AKOS033928022,
Z2492774487,
|
| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.676g/mol |
| Monoisotopic Mass | 231.066g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 83.6A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number