TL;DR: 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate (CAS 155330-43-1) is a chemical compound with molecular formula C10H18O7P2 and molecular weight 312.05276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(E)-6-cyclopropylidene-3-methylhex-2-enyl] phosphono hydrogen phosphate
Also Known As: Cpmh-opp, 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate, 6-Cyclopropylidene-3E-methyl-hex-2-en-1-yl pyrophosphate, [(E)-6-cyclopropylidene-3-methylhex-2-enyl] phosphono hydrogen phosphate, [({[(2E)-6-cyclopropylidene-3-methylhex-2-en-1-yl]oxy}(hydroxy)phosphoryl)oxy]phosphonic acid
| Molecular Formula | C10H18O7P2 |
| Molecular Weight | 312.05276 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.05276 Da |
| Heavy Atoms | 19 |
| Complexity | 456.0 |
| SMILES | C/C(=C\COP(=O)(O)OP(=O)(O)O)/CCC=C1CC1 |
| InChIKey | CBQMAJDOQMZKMG-VQHVLOKHSA-N |
The XLogP value of -0.4 indicates that 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate. Following Lipinski's Rule of Five, 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate is 155330-43-1.
The molecular formula of 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate is C10H18O7P2.
The molecular weight of 6-Cyclopropylidene-3-methyl-2-hexen-1-yl pyrophosphate is 312.05276 g/mol.
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