| CAS Number | 1670275-12-3 |
| Catalog Number | AG01BV2Z |
| Chemical Name | 2-[methyl(2-phenylethyl)amino]acetic acid hydrochloride |
| IUPAC Name | 2-[methyl(2-phenylethyl)amino]acetic acid;hydrochloride |
| InChI | InChI=1S/C11H15NO2.ClH/c1-12(9-11(13)14)8-7-10-5-3-2-4-6-10;/h2-6H,7-9H2,1H3,(H,13,14);1H |
| InChI Key | XPHZAPNAEWCVGB-UHFFFAOYSA-N |
| MDL Number | MFCD30476233 |
| Molecular Formula | C11H16ClNO2 |
| Molecular Weight | 229.7032 |
| SMILES | Cl.CN(CC(O)=O)CCC1=CC=CC=C1 |
| Synonyms | 2-[methyl(2-phenylethyl)amino]acetic acid hydrochloride,
1670275-12-3,
Z1459897052,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.704g/mol |
| Monoisotopic Mass | 229.087g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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