| CAS Number | 35761-15-0 |
| Catalog Number | AG01BJAP |
| Chemical Name | (3S)-3,6-Diaminohexanoic acid dihydrochloride |
| IUPAC Name | 3,6-diaminohexanoic acid;dihydrochloride |
| InChI | InChI=1S/C6H14N2O2.2ClH/c7-3-1-2-5(8)4-6(9)10;;/h5H,1-4,7-8H2,(H,9,10);2*1H |
| InChI Key | ATIYVUIIEUEADI-UHFFFAOYSA-N |
| MDL Number | MFCD17170073 |
| Molecular Formula | C6H16Cl2N2O2 |
| Molecular Weight | 219.1094 |
| SMILES | C(C[C@@H](CC(=O)O)N)CN.Cl.Cl |
| Synonyms | (3S)-3,6-diaminohexanoic acid dihydrochloride,
35761-15-0,
|
| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.106g/mol |
| Monoisotopic Mass | 218.059g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 89.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number