| CAS Number | 4418-81-9 |
| Catalog Number | AG00DETB(AGN-PC-0RSBO8) |
| Chemical Name | Lysinoalanine Dihydrochloride |
| IUPAC Name | (2S)-2-amino-6-[(2-amino-2-carboxyethyl)amino]hexanoic acid;dihydrochloride |
| InChI | InChI=1S/C9H19N3O4.2ClH/c10-6(8(13)14)3-1-2-4-12-5-7(11)9(15)16;;/h6-7,12H,1-5,10-11H2,(H,13,14)(H,15,16);2*1H/t6-,7?;;/m0../s1 |
| InChI Key | JZWLEIXRHPXDAP-VNGAUYPHSA-N |
| MDL Number | MFCD00058086 |
| Molecular Formula | C9H21Cl2N3O4 |
| Molecular Weight | 306.1867 |
| SMILES | Cl.Cl.N[C@@H](CCCCNCC(N)C(=O)O)C(=O)O |
| Synonyms | LAL 2 HCl,
4418-81-9,
Lysinoalanine 2 HCll (diastereomeric mixture: LL + LD,
LAL . 2 HCl,
C9H19N3O4.2HCl,
7357AH,
MFCD00058086,
FT-0603660,
C-19038,
Lysinoalanine 2 HCl (diastereomeric mixture: LL + LD),
(2S)-2-amino-6-(2-amino-2-carboxyethylamino)hexanoic acid dihydrochloride,
Lysinoalanine,
Lysinoalanine Dihydrochloride,
JZWLEIXRHPXDAP-VNGAUYPHSA-N,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 7 |
| Isotope Atom Count | 0 |
| Molecular Weight | 306.184g/mol |
| Monoisotopic Mass | 305.091g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 139A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number