TL;DR: (E)-1-Propenyl 2-propenyl disulfide (CAS 122156-02-9) is a chemical compound with molecular formula C6H10S2 and molecular weight 146.0224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(prop-2-enyldisulfanyl)prop-1-ene
Also Known As: allyl propenyl disulfide, Disulfide, allyl propenyl, Allyl prop-1-enyl disulfide, allyl 1-propenyl disulfide, Fema No. 4823
| Molecular Formula | C6H10S2 |
| Molecular Weight | 146.0224 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.0224 Da |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
| SMILES | C/C=C/SSCC=C |
| InChIKey | KBXOGESWPIVMNJ-GQCTYLIASA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-Propenyl 2-propenyl disulfide. With a topological polar surface area (TPSA) of 50.6 Ų, (E)-1-Propenyl 2-propenyl disulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1-Propenyl 2-propenyl disulfide 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 (E)-1-Propenyl 2-propenyl disulfide is 122156-02-9.
The molecular formula of (E)-1-Propenyl 2-propenyl disulfide is C6H10S2.
The molecular weight of (E)-1-Propenyl 2-propenyl disulfide is 146.0224 g/mol.
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