TL;DR: n-Butyl lithium (CAS 109-72-8) is a chemical compound with molecular formula C4H9Li and molecular weight 64.086426 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
正丁基锂
lithium butane
Also Known As: N-butyllithium, BUTYLLITHIUM, Lithium, butyl-, Butyl lithium, lithium;butane
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C4H9Li |
| Molecular Weight | 64.086426 g/mol |
| XLogP | -1.38 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 64.086426 Da |
| Heavy Atoms | 5 |
| Complexity | 7.0 |
| SMILES | [Li+].CCC[CH2-] |
| InChIKey | DLEDOFVPSDKWEF-UHFFFAOYSA-N |
The XLogP value of -1.38 indicates that n-Butyl lithium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, n-Butyl lithium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl lithium 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 n-Butyl lithium is 109-72-8.
The molecular formula of n-Butyl lithium is C4H9Li.
The molecular weight of n-Butyl lithium is 64.086426 g/mol.
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