benzyl-(2-chloroethyl)-ethyl-methylazaniummethyl sulfate
benzyl-(2-chloroethyl)-ethyl-methylazanium;methyl sulfate
| Molecular Formula | C13H22ClNO4S |
|---|---|
| Molecular Weight | 323.84 g/mol |
| Topological Polar Surface Area | 74.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.0958 |
| Heavy Atoms | 20 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 66902-69-0 |
|---|---|
| SMILES | CC[N+](C)(CCCl)CC1=CC=CC=C1.COS(=O)(=O)[O-] |
| InChIKey | MWKUVOJSLLBIPM-UHFFFAOYSA-M |
📖 Product Overview
benzyl-(2-chloroethyl)-ethyl-methylazaniummethyl sulfate (CAS: 66902-69-0) is a chemical compound with molecular formula C13H22ClNO4S and molecular weight 323.84 g/mol. Its IUPAC systematic name is benzyl-(2-chloroethyl)-ethyl-methylazanium;methyl sulfate.
MWKUVOJSLLBIPM-UHFFFAOYSA-M.
SMILES: CC[N+](C)(CCCl)CC1=CC=CC=C1.COS(=O)(=O)[O-].
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