2-(4-bromophenyl)sulfanylacetatetris(2-hydroxyethyl)azanium
2-(4-bromophenyl)sulfanylacetate;tris(2-hydroxyethyl)azanium
| Molecular Formula | C14H22BrNO5S |
|---|---|
| Molecular Weight | 396.3 g/mol |
| Topological Polar Surface Area | 131.0 A2 |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 395.04022 |
| Heavy Atoms | 22 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 87298-90-6 |
|---|---|
| SMILES | C1=CC(=CC=C1SCC(=O)[O-])Br.C(CO)[NH+](CCO)CCO |
| InChIKey | HJNRMJOXVCOCJL-UHFFFAOYSA-N |
📖 Product Overview
2-(4-bromophenyl)sulfanylacetatetris(2-hydroxyethyl)azanium (CAS: 87298-90-6) is a chemical compound with molecular formula C14H22BrNO5S and molecular weight 396.3 g/mol. Its IUPAC systematic name is 2-(4-bromophenyl)sulfanylacetate;tris(2-hydroxyethyl)azanium.
HJNRMJOXVCOCJL-UHFFFAOYSA-N.
SMILES: C1=CC(=CC=C1SCC(=O)[O-])Br.C(CO)[NH+](CCO)CCO.
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