1-N-Boc-pyrrolidin-2-ylboronic acid
TL;DR: 1-N-Boc-pyrrolidin-2-ylboronic acid (CAS 149716-79-0) is a chemical compound with molecular formula C9H18BNO4 and molecular weight 215.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]boronic acid
Also Known As: 1-N-Boc-pyrrolidin-2-ylboronic acid, 1-Boc-Pyrrolidine-2-boronic acid, N-Boc-2-pyrroleboronic acid, N-Boc-pyrrolidin-2-ylboronic acid, N-Boc-Pyrrolidin-2-(R)-ylboronic acid
| Molecular Formula | C9H18BNO4 |
|---|---|
| Molecular Weight | 215.13 g/mol |
| LogP | 0.3979 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.13289 |
| Heavy Atoms | 15 |
| Complexity | 238.75706 |
Chemical Identifiers
| CAS Number | 149716-79-0 |
|---|---|
| SMILES | B(C1CCCN1C(=O)OC(C)(C)C)(O)O |
Product Overview
1-N-Boc-pyrrolidin-2-ylboronic acid (CAS 149716-79-0), with molecular formula C9H18BNO4 and molecular weight 215.13 g/mol. IUPAC: [1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]boronic acid.
Chemical Property Profile of 1-N-Boc-pyrrolidin-2-ylboronic acid
Property Insights of 1-N-Boc-pyrrolidin-2-ylboronic acid
The XLogP value of 0.3979 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-N-Boc-pyrrolidin-2-ylboronic acid. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-N-Boc-pyrrolidin-2-ylboronic acid. Following Lipinski's Rule of Five, 1-N-Boc-pyrrolidin-2-ylboronic acid has 2 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 1-N-Boc-pyrrolidin-2-ylboronic acid?
The CAS number of 1-N-Boc-pyrrolidin-2-ylboronic acid is 149716-79-0.
What is the molecular formula of 1-N-Boc-pyrrolidin-2-ylboronic acid?
The molecular formula of 1-N-Boc-pyrrolidin-2-ylboronic acid is C9H18BNO4.
What is the molecular weight of 1-N-Boc-pyrrolidin-2-ylboronic acid?
The molecular weight of 1-N-Boc-pyrrolidin-2-ylboronic acid is 215.13 g/mol.
Where can I buy 1-N-Boc-pyrrolidin-2-ylboronic acid?
You can request a quote for 1-N-Boc-pyrrolidin-2-ylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-N-Boc-pyrrolidin-2-ylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-N-Boc-pyrrolidin-2-ylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.