PENTHIENATE BROMIDE
2-(2-cyclopentyl-2-hydroxy-2-thiophen-2-ylacetyl)oxyethyl-diethyl-methylazanium bromide
| Molecular Formula | C18H30BrNO3S |
|---|---|
| Molecular Weight | 420.4 g/mol |
| Topological Polar Surface Area | 74.8 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 419.11298 |
| Heavy Atoms | 24 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 60-44-6 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC(=O)C(C1CCCC1)(C2=CC=CS2)O.[Br-] |
| InChIKey | VWGJUXTWIWCQGL-UHFFFAOYSA-M |
📖 Product Overview
PENTHIENATE BROMIDE (CAS: 60-44-6) is a chemical compound with molecular formula C18H30BrNO3S and molecular weight 420.4 g/mol. Its IUPAC systematic name is 2-(2-cyclopentyl-2-hydroxy-2-thiophen-2-ylacetyl)oxyethyl-diethyl-methylazanium bromide.
VWGJUXTWIWCQGL-UHFFFAOYSA-M.
SMILES: CC[N+](C)(CC)CCOC(=O)C(C1CCCC1)(C2=CC=CS2)O.[Br-].
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