Dicethiamine hydrochloride
ethyl [2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-ethoxycarbonyloxypent-2-en-3-yl]sulfanylformate;hydrochloride
Also Known As: Dicethiamine hydrochloride
| Molecular Formula | C18H27ClN4O6S |
|---|---|
| Molecular Weight | 462.13397 g/mol |
| LogP | 3.43 |
| Topological Polar Surface Area | 133.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 462.13397 |
| Heavy Atoms | 30 |
| Complexity | 762.2 |
Chemical Identifiers
| CAS Number | 616-96-6 |
|---|---|
| SMILES | CCOC(=O)OCCC(=C(C)N(CC1=CN=C(N=C1N)C)C=O)SC(=O)OCC.Cl |
Product Overview
Dicethiamine hydrochloride (CAS 616-96-6), with molecular formula C18H27ClN4O6S and molecular weight 462.13397 g/mol. IUPAC: ethyl [2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-ethoxycarbonyloxypent-2-en-3-yl]sulfanylformate;hydrochloride.
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