Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-
TL;DR: Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- (CAS 22516-41-2) is a chemical compound with molecular formula C12H22BN and molecular weight 191.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(9-borabicyclo[3.3.1]nonan-9-yl)pyrrolidine
Also Known As: 9-pyrrolidino-9-borabicyclo-{3,3,1}-nonane, 9-Pyrrolizino-9-borabicyclo[3.3.1]nonane, J2.883.322I, 1-(9-Borabicyclo[3.3.1]non-9-yl)pyrrolidine, 1-(9-Borabicyclo[3.3.1]non-9-yl)pyrrolidine #
| Molecular Formula | C12H22BN |
|---|---|
| Molecular Weight | 191.18 g/mol |
| LogP | 3.1819 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.18452 |
| Heavy Atoms | 14 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 22516-41-2 |
|---|---|
| SMILES | B1(C2CCCC1CCC2)N3CCCC3 |
| InChIKey | ZTGJKMQEPZRNDE-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- (CAS 22516-41-2), with molecular formula C12H22BN and molecular weight 191.18 g/mol. IUPAC: 1-(9-borabicyclo[3.3.1]nonan-9-yl)pyrrolidine.
Chemical Property Profile of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-
Property Insights of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-
The XLogP value of 3.1819 indicates that Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- has 0 hydrogen bond donor(s) and 1 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 Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-?
The CAS number of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- is 22516-41-2.
What is the molecular formula of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-?
The molecular formula of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- is C12H22BN.
What is the molecular weight of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-?
The molecular weight of Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- is 191.18 g/mol.
Where can I buy Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-?
You can request a quote for Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(9-borabicyclo[3.3.1]non-9-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.