TL;DR: Propane, 1-(ethenylthio)- (CAS 16330-21-5) is a chemical compound with molecular formula C5H10S and molecular weight 102.05032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethenylsulfanylpropane
Also Known As: Propane, 1-(ethenylthio)-, 3-Thia-1-hexene, Propylvinyl sulfide, propyl vinyl sulfide, 1-(Propylsulfanyl)ethylene
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C5H10S |
| Molecular Weight | 102.05032 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 102.05032 Da |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| SMILES | CCCSC=C |
| InChIKey | HWRMMWBUMQCMJK-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propane, 1-(ethenylthio)-. With a topological polar surface area (TPSA) of 25.3 Ų, Propane, 1-(ethenylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propane, 1-(ethenylthio)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Propane, 1-(ethenylthio)- is 16330-21-5.
The molecular formula of Propane, 1-(ethenylthio)- is C5H10S.
The molecular weight of Propane, 1-(ethenylthio)- is 102.05032 g/mol.
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