N,N-Dimethyl-11H-dibenz(b,f)-1,4-oxathiepin-11-ethanamine oxalate
2-(6H-benzo[b][1,5]benzoxathiepin-6-yl)ethyl-dimethylazanium;2-hydroxy-2-oxoacetate
Also Known As: AC1L1HU9|N,N-Dimethyl-11H-dibenz(b,f)-1,4-oxathiepin-11-ethanamine oxalate|11-(2-Dimethylaminoethyl)-11H-dibenzo(b,f)-1,4-oxathiepin hydrogen oxalate|11H-DIBENZ(b,f)-1,4-OXATHIEPIN-11-ETHANAMINE, N,N-DIMETHYL-, ETHANEDIOATE|2-(6H-benzo[b][1,5]benzoxathiepin-6-yl)ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate
| Molecular Formula | C19H21NO5S |
|---|---|
| Molecular Weight | 375.11404 g/mol |
| LogP | 0.98 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.11404 |
| Heavy Atoms | 26 |
| Complexity | 766.0 |
Chemical Identifiers
| CAS Number | 82387-03-9 |
|---|---|
| SMILES | C[NH+](C)CCC1C2=CC=CC=C2OC3=CC=CC=C3S1.C(=O)(C(=O)[O-])O |
Product Overview
N,N-Dimethyl-11H-dibenz(b,f)-1,4-oxathiepin-11-ethanamine oxalate (CAS 82387-03-9), with molecular formula C19H21NO5S and molecular weight 375.11404 g/mol. IUPAC: 2-(6H-benzo[b][1,5]benzoxathiepin-6-yl)ethyl-dimethylazanium;2-hydroxy-2-oxoacetate.
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