| CAS Number | 908571-75-5 |
| Catalog Number | AG00IGBB(AGN-PC-0WAMIH) |
| Chemical Name | (S)-2-Amino-3-(3-aminophenyl)propanoic acid dihydrochloride |
| IUPAC Name | (2S)-2-amino-3-(3-aminophenyl)propanoic acid;dihydrochloride |
| InChI | InChI=1S/C9H12N2O2.2ClH/c10-7-3-1-2-6(4-7)5-8(11)9(12)13;;/h1-4,8H,5,10-11H2,(H,12,13);2*1H/t8-;;/m0../s1 |
| InChI Key | KUYMDLJJQHYMCD-JZGIKJSDSA-N |
| MDL Number | MFCD29919675 |
| Molecular Formula | C9H14Cl2N2O2 |
| Molecular Weight | 253.1257 |
| SMILES | O=C(O)[C@@H](N)CC1=CC=CC(N)=C1.[H]Cl.[H]Cl |
| Synonyms | (S)-2-Amino-3-(3-aminophenyl)propanoic acid dihydrochloride,
908571-75-5,
AK325880,
KS-00000LAJ,
MFCD29919675,
AKOS027250605,
DS-11795,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.123g/mol |
| Monoisotopic Mass | 252.043g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 89.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number