TL;DR: 2-Ethylvaline (CAS 106247-34-1) is a chemical compound with molecular formula C7H15NO2 and molecular weight 145.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-2-ethyl-3-methylbutanoic acid
Also Known As: 2-ethylvaline, Valine, 2-ethyl-, 2-amino-2-ethyl-3-methylbutanoic acid, NCI60_003409
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H15NO2 |
| Molecular Weight | 145.11028 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 145.11028 Da |
| Heavy Atoms | 10 |
| Complexity | 134.0 |
| SMILES | CCC(C(C)C)(C(=O)O)N |
| InChIKey | ZREHYDMEQQDRGS-UHFFFAOYSA-N |
The XLogP value of -1.3 indicates that 2-Ethylvaline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethylvaline. Following Lipinski's Rule of Five, 2-Ethylvaline has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Ethylvaline is 106247-34-1.
The molecular formula of 2-Ethylvaline is C7H15NO2.
The molecular weight of 2-Ethylvaline is 145.11028 g/mol.
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