TL;DR: 1-Butynyltrimethylsilane (CAS 62108-37-6) is a chemical compound with molecular formula C7H14Si and molecular weight 126.08648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-1-ynyl(trimethyl)silane
Also Known As: but-1-yn-1-yltrimethylsilane, 1-Butynyltrimethylsilane, 1-TRIMETHYLSILYL-1-BUTYNE, 1-(Trimethylsilyl)-1-butyne, but-1-ynyl(trimethyl)silane
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H14Si |
| Molecular Weight | 126.08648 g/mol |
| XLogP | 2.28 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.08648 Da |
| Heavy Atoms | 8 |
| Complexity | 116.0 |
| SMILES | CCC#C[Si](C)(C)C |
| InChIKey | QKUFWNQHBGARJY-UHFFFAOYSA-N |
The XLogP value of 2.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butynyltrimethylsilane. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Butynyltrimethylsilane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butynyltrimethylsilane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Butynyltrimethylsilane is 62108-37-6.
The molecular formula of 1-Butynyltrimethylsilane is C7H14Si.
The molecular weight of 1-Butynyltrimethylsilane is 126.08648 g/mol.
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