Boc-(R)-alpha-(3-chlorobenzyl)proline
TL;DR: Boc-(R)-alpha-(3-chlorobenzyl)proline (CAS 706806-68-0) is a chemical compound with molecular formula C17H22ClNO4 and molecular weight 339.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[(3-chlorophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Also Known As: Boc-(R)-alpha-(3-chlorobenzyl)proline, Boc-{Bzl(3-Cl)}Pro-OH, BOC-(R)-ALPHA-(3-CHLORO-BENZYL)-PROLINE, Boc-(R)-alpha-(3-chlorobenzyl)-proline, J1.945.770B
| Molecular Formula | C17H22ClNO4 |
|---|---|
| Molecular Weight | 339.12 g/mol |
| LogP | 3.7368 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.12375 |
| Heavy Atoms | 23 |
| Complexity | 610.8561 |
Chemical Identifiers
| CAS Number | 706806-68-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC[C@@]1(CC2=CC(=CC=C2)Cl)C(=O)O |
Product Overview
Boc-(R)-alpha-(3-chlorobenzyl)proline (CAS 706806-68-0), with molecular formula C17H22ClNO4 and molecular weight 339.12 g/mol. IUPAC: (2R)-2-[(3-chlorophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of Boc-(R)-alpha-(3-chlorobenzyl)proline
Property Insights of Boc-(R)-alpha-(3-chlorobenzyl)proline
The XLogP value of 3.7368 indicates that Boc-(R)-alpha-(3-chlorobenzyl)proline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-(R)-alpha-(3-chlorobenzyl)proline. Following Lipinski's Rule of Five, Boc-(R)-alpha-(3-chlorobenzyl)proline 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
Frequently Asked Questions
What is the CAS number of Boc-(R)-alpha-(3-chlorobenzyl)proline?
The CAS number of Boc-(R)-alpha-(3-chlorobenzyl)proline is 706806-68-0.
What is the molecular formula of Boc-(R)-alpha-(3-chlorobenzyl)proline?
The molecular formula of Boc-(R)-alpha-(3-chlorobenzyl)proline is C17H22ClNO4.
What is the molecular weight of Boc-(R)-alpha-(3-chlorobenzyl)proline?
The molecular weight of Boc-(R)-alpha-(3-chlorobenzyl)proline is 339.12 g/mol.
Where can I buy Boc-(R)-alpha-(3-chlorobenzyl)proline?
You can request a quote for Boc-(R)-alpha-(3-chlorobenzyl)proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-(R)-alpha-(3-chlorobenzyl)proline?
Yes, KEHONG BIO provides custom synthesis services for Boc-(R)-alpha-(3-chlorobenzyl)proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.