Boc-L-proline 4-nitrophenyl ester
TL;DR: Boc-L-proline 4-nitrophenyl ester (CAS 28310-65-8) is a chemical compound with molecular formula C16H20N2O6 and molecular weight 336.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-tert-butyl 2-O-(4-nitrophenyl) pyrrolidine-1,2-dicarboxylate
Also Known As: BOC-PRO-ONP, Boc-L-Pro-Onp, Boc-L-proline 4-nitrophenyl ester, 1-tert-butyl 2-(4-nitrophenyl) pyrrolidine-1,2-dicarboxylate, 1-O-tert-butyl 2-O-(4-nitrophenyl) pyrrolidine-1,2-dicarboxylate
| Molecular Formula | C16H20N2O6 |
|---|---|
| Molecular Weight | 336.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.13214 |
| Heavy Atoms | 24 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 28310-65-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCCC1C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GUVOBXQVANZIKH-UHFFFAOYSA-N |
Product Overview
Boc-L-proline 4-nitrophenyl ester (CAS 28310-65-8), with molecular formula C16H20N2O6 and molecular weight 336.13 g/mol. IUPAC: 1-O-tert-butyl 2-O-(4-nitrophenyl) pyrrolidine-1,2-dicarboxylate.
Chemical Property Profile of Boc-L-proline 4-nitrophenyl ester
Property Insights of Boc-L-proline 4-nitrophenyl ester
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-L-proline 4-nitrophenyl ester. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-L-proline 4-nitrophenyl ester. Following Lipinski's Rule of Five, Boc-L-proline 4-nitrophenyl ester has 0 hydrogen bond donor(s) and 6 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-L-proline 4-nitrophenyl ester?
The CAS number of Boc-L-proline 4-nitrophenyl ester is 28310-65-8.
What is the molecular formula of Boc-L-proline 4-nitrophenyl ester?
The molecular formula of Boc-L-proline 4-nitrophenyl ester is C16H20N2O6.
What is the molecular weight of Boc-L-proline 4-nitrophenyl ester?
The molecular weight of Boc-L-proline 4-nitrophenyl ester is 336.13 g/mol.
Where can I buy Boc-L-proline 4-nitrophenyl ester?
You can request a quote for Boc-L-proline 4-nitrophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-L-proline 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Boc-L-proline 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.