(2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine
TL;DR: (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine (CAS 525538-12-9) is a chemical compound with molecular formula C11H14FN and molecular weight 179.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-3-methylpyrrolidine
Also Known As: 2-(4-fluorophenyl)-3-methylpyrrolidine, 2-(4-fluorophenyl)-3-methyl-pyrrolidine, (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine
| Molecular Formula | C11H14FN |
|---|---|
| Molecular Weight | 179.11 g/mol |
| LogP | 2.4962 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.11102 |
| Heavy Atoms | 13 |
| Complexity | 280.64667 |
Chemical Identifiers
| CAS Number | 525538-12-9 |
|---|---|
| SMILES | CC1CCNC1C2=CC=C(C=C2)F |
Product Overview
(2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine (CAS 525538-12-9), with molecular formula C11H14FN and molecular weight 179.11 g/mol. IUPAC: 2-(4-fluorophenyl)-3-methylpyrrolidine.
Chemical Property Profile of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine
Property Insights of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine
The XLogP value of 2.4962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine. With a topological polar surface area (TPSA) of 12.03 Ų, (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine has 1 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 (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine?
The CAS number of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine is 525538-12-9.
What is the molecular formula of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine?
The molecular formula of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine is C11H14FN.
What is the molecular weight of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine?
The molecular weight of (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine is 179.11 g/mol.
Where can I buy (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine?
You can request a quote for (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for (2RS,3RS)-2-(4-fluoro-phenyl)-3-methyl-pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.