TL;DR: Diallyl cyclohexane-1,4-diylbis(methylenecarbonate) (CAS 36528-45-7) is a chemical compound with molecular formula C16H24O6 and molecular weight 312.1573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(prop-2-enoxycarbonyloxymethyl)cyclohexyl]methyl prop-2-enyl carbonate
Also Known As: Diallyl cyclohexane-1,4-diylbis(methylenecarbonate), cyclohexane-1,4-diyldimethanediyl diprop-2-en-1-yl biscarbonate, 1,4-Cyclohexanedimethanol bis(carbonic acid allyl) ester, [4-(prop-2-enoxycarbonyloxymethyl)cyclohexyl]methyl prop-2-enyl carbonate, (Cyclohexane-1,4-diyl)bis(methylene) diprop-2-en-1-yl biscarbonate
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H24O6 |
| Molecular Weight | 312.1573 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 312.1573 Da |
| Heavy Atoms | 22 |
| Complexity | 335.0 |
| SMILES | C=CCOC(=O)OCC1CCC(CC1)COC(=O)OCC=C |
| InChIKey | FBMMWSZSVHIASG-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that Diallyl cyclohexane-1,4-diylbis(methylenecarbonate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diallyl cyclohexane-1,4-diylbis(methylenecarbonate). Following Lipinski's Rule of Five, Diallyl cyclohexane-1,4-diylbis(methylenecarbonate) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diallyl cyclohexane-1,4-diylbis(methylenecarbonate) is 36528-45-7.
The molecular formula of Diallyl cyclohexane-1,4-diylbis(methylenecarbonate) is C16H24O6.
The molecular weight of Diallyl cyclohexane-1,4-diylbis(methylenecarbonate) is 312.1573 g/mol.
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