TL;DR: 2-Propenyl bis(chloromethyl) phosphinate (CAS 14212-97-6) is a chemical compound with molecular formula C5H9Cl2O2P and molecular weight 201.97173 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[bis(chloromethyl)phosphoryloxy]prop-1-ene
Also Known As: 2-PROPENYL BIS(CHLOROMETHYL) PHOSPHINATE, prop-2-en-1-yl bis(chloromethyl)phosphinate, 3-[bis(chloromethyl)phosphoryloxy]prop-1-ene, J1.564.637C, Bis(chloromethyl)phosphinic acid 2-propenyl ester
| Molecular Formula | C5H9Cl2O2P |
| Molecular Weight | 201.97173 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 201.97173 Da |
| Heavy Atoms | 10 |
| Complexity | 141.0 |
| SMILES | C=CCOP(=O)(CCl)CCl |
| InChIKey | QKIAFJJZQJDJPK-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenyl bis(chloromethyl) phosphinate. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Propenyl bis(chloromethyl) phosphinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenyl bis(chloromethyl) phosphinate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propenyl bis(chloromethyl) phosphinate is 14212-97-6.
The molecular formula of 2-Propenyl bis(chloromethyl) phosphinate is C5H9Cl2O2P.
The molecular weight of 2-Propenyl bis(chloromethyl) phosphinate is 201.97173 g/mol.
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