TL;DR: p,p'-Dibrom-dibenzylquecksilber (CAS 1148-49-8) is a chemical compound with molecular formula C37H66O7 and molecular weight 622.48083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[12,13-dihydroxy-13-[5-[5-(1-hydroxyundecyl)oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
Also Known As: p,p'-Dibrom-dibenzylquecksilber, 2(5H)-Furanone, 3-(12,13-dihydroxy-13-(octahydro-5'-(1-hydroxyundecyl)(2,2'-bifuran)-5-yl)tridecyl)-5-methyl-, 2(5H)-Furanone,3-[12,13-dihydroxy-13-[octahydro-5'-(1-hydroxyundecyl)[2,2'-bifuran]-5-yl]tridecyl]-5-methyl-(9CI), 3-{12,13-dihydroxy-13-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]tridecyl}-5-methylfuran-2(5h)-one, 4-[12,13-dihydroxy-13-[5-[5-(1-hydroxyundecyl)oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
| Molecular Formula | C37H66O7 |
| Molecular Weight | 622.48083 g/mol |
| XLogP | 10.1 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 25 |
| Exact Mass | 622.48083 Da |
| Heavy Atoms | 44 |
| Complexity | 801.0 |
| SMILES | CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(C(CCCCCCCCCCCC3=CC(OC3=O)C)O)O)O |
| InChIKey | LOBTVFMXMAFWGY-UHFFFAOYSA-N |
The XLogP value of 10.1 indicates that p,p'-Dibrom-dibenzylquecksilber is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for p,p'-Dibrom-dibenzylquecksilber. Following Lipinski's Rule of Five, p,p'-Dibrom-dibenzylquecksilber has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of p,p'-Dibrom-dibenzylquecksilber is 1148-49-8.
The molecular formula of p,p'-Dibrom-dibenzylquecksilber is C37H66O7.
The molecular weight of p,p'-Dibrom-dibenzylquecksilber is 622.48083 g/mol.
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