Boc-Pyr-OtBu
TL;DR: Boc-Pyr-OtBu (CAS 91237-84-2) is a chemical compound with molecular formula C14H25NO4 and molecular weight 271.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl (2S)-pyrrolidine-1,2-dicarboxylate
Also Known As: Boc-Pyr-OtBu, Boc-L-PyroglutamicAcidTert-ButylEster, N-BOC-Proline tert-Butyl Ester, 1-Boc-L-Proline tert-butyl ester, N-t-butyloxycarbonyl-L-proline t-butyl ester
| Molecular Formula | C14H25NO4 |
|---|---|
| Molecular Weight | 271.18 g/mol |
| LogP | 2.7276 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 271.17834 |
| Heavy Atoms | 19 |
| Complexity | 317.43793 |
Chemical Identifiers
| CAS Number | 91237-84-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C |
Product Overview
Boc-Pyr-OtBu (CAS 91237-84-2), with molecular formula C14H25NO4 and molecular weight 271.18 g/mol. IUPAC: ditert-butyl (2S)-pyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of Boc-Pyr-OtBu
Property Insights of Boc-Pyr-OtBu
The XLogP value of 2.7276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-Pyr-OtBu. With a topological polar surface area (TPSA) of 55.84 Ų, Boc-Pyr-OtBu exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Boc-Pyr-OtBu has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Boc-Pyr-OtBu?
The CAS number of Boc-Pyr-OtBu is 91237-84-2.
What is the molecular formula of Boc-Pyr-OtBu?
The molecular formula of Boc-Pyr-OtBu is C14H25NO4.
What is the molecular weight of Boc-Pyr-OtBu?
The molecular weight of Boc-Pyr-OtBu is 271.18 g/mol.
Where can I buy Boc-Pyr-OtBu?
You can request a quote for Boc-Pyr-OtBu directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-Pyr-OtBu?
Yes, KEHONG BIO provides custom synthesis services for Boc-Pyr-OtBu and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.