TL;DR: tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate (CAS 106391-87-1) is a chemical compound with molecular formula C10H21NO3 and molecular weight 203.15215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate
Also Known As: N-Boc-L-valinol, Boc-L-valinol, Boc-Valinol, Boc-D-valinol, Boc-Val-ol
| Molecular Formula | C10H21NO3 |
| Molecular Weight | 203.15215 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 203.15215 Da |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
| SMILES | CC(C)[C@@H](CO)NC(=O)OC(C)(C)C |
| InChIKey | OOQRRYDVICNJGC-MRVPVSSYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate. With a topological polar surface area (TPSA) of 58.6 Ų, tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate 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 tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate is 106391-87-1.
The molecular formula of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate is C10H21NO3.
The molecular weight of tert-butyl N-[(2S)-1-hydroxy-3-methylbutan-2-yl]carbamate is 203.15215 g/mol.
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