Boc-leu-chloromethylketone
TL;DR: Boc-leu-chloromethylketone (CAS 102123-85-3) is a chemical compound with molecular formula C12H22ClNO3 and molecular weight 263.1288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(3S)-1-chloro-5-methyl-2-oxohexan-3-yl]carbamate
Also Known As: BOC-LEU-CHLOROMETHYLKETONE, Boc-L-Leu-chloromethylketone, Boc-LeuCH2Cl, Boc-Leu-CMK, Boc-L-Leu-CMK
Technical Specifications
| Molecular Formula | C12H22ClNO3 |
| Molecular Weight | 263.1288 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 263.1288 Da |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
| SMILES | CC(C)C[C@@H](C(=O)CCl)NC(=O)OC(C)(C)C |
| InChIKey | ZNJWTNDBZSOFFP-VIFPVBQESA-N |
Chemical Property Profile of Boc-leu-chloromethylketone
Property Insights of Boc-leu-chloromethylketone
The XLogP value of 3.0 indicates that Boc-leu-chloromethylketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Boc-leu-chloromethylketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Boc-leu-chloromethylketone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Boc-leu-chloromethylketone?
The CAS number of Boc-leu-chloromethylketone is 102123-85-3.
What is the molecular formula of Boc-leu-chloromethylketone?
The molecular formula of Boc-leu-chloromethylketone is C12H22ClNO3.
What is the molecular weight of Boc-leu-chloromethylketone?
The molecular weight of Boc-leu-chloromethylketone is 263.1288 g/mol.
Where can I buy Boc-leu-chloromethylketone?
You can request a quote for Boc-leu-chloromethylketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-leu-chloromethylketone?
Yes, CoreyChem provides custom synthesis services for Boc-leu-chloromethylketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.