AC1MIIF1
2,5-bis[[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy]benzenesulfonic acid;piperazine
Also Known As: Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 2-sulfo-1,4-phenylene ester, compd. with piperazine (1:1)|2,5-bis[[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy]benzenesulfonic Acid; Piperazine|2,5-bis[[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy]benzenesulfonic acid; piperazine|2,5-bis[[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy]benzenesulfonic acid;piperazine|2,5-Bis{[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy}benzene-1-sulfonic acid--piperazine (1/1)
| Molecular Formula | C30H34Cl2N2O9S |
|---|---|
| Molecular Weight | 668.1362 g/mol |
| LogP | 4.9453 |
| Topological Polar Surface Area | 149.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 668.1362 |
| Monoisotopic Mass | 668.1362 |
| Heavy Atoms | 44 |
| Complexity | 1530.1771 |
Chemical Identifiers
| CAS Number | 58357-73-6 |
|---|---|
| SMILES | CC(C)(C(=O)OC1=CC(=C(C=C1)OC(=O)C(C)(C)OC2=CC=C(C=C2)Cl)S(=O)(=O)O)OC3=CC=C(C=C3)Cl.C1CNCCN1 |
Product Overview
AC1MIIF1 (CAS 58357-73-6), with molecular formula C30H34Cl2N2O9S and molecular weight 668.1362 g/mol. IUPAC: 2,5-bis[[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy]benzenesulfonic acid;piperazine.
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