1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol
TL;DR: 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol (CAS 3680-41-9) is a chemical compound with molecular formula C13H18BrNO2 and molecular weight 299.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol
Also Known As: 1-(2-bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol, 1-(2-Bromophenoxy)-3-(pyrrolidin-1-yl)propan-2-ol, CHEMBRDG-BB 6801729, 7-methyl-1,3-dihydroindol-2-one, 1-(2-bromophenoxy)-3-pyrrolidin-1-yl-propan-2-ol
| Molecular Formula | C13H18BrNO2 |
|---|---|
| Molecular Weight | 299.05 g/mol |
| LogP | 2.2846 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.0521 |
| Heavy Atoms | 17 |
| Complexity | 353.02762 |
Chemical Identifiers
| CAS Number | 3680-41-9 |
|---|---|
| SMILES | C1CCN(C1)CC(COC2=CC=CC=C2Br)O |
Product Overview
1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol (CAS 3680-41-9), with molecular formula C13H18BrNO2 and molecular weight 299.05 g/mol. IUPAC: 1-(2-bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol.
Chemical Property Profile of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol
Property Insights of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol
The XLogP value of 2.2846 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol. With a topological polar surface area (TPSA) of 32.7 Ų, 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol 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 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol?
The CAS number of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol is 3680-41-9.
What is the molecular formula of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol?
The molecular formula of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol is C13H18BrNO2.
What is the molecular weight of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol?
The molecular weight of 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol is 299.05 g/mol.
Where can I buy 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol?
You can request a quote for 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromophenoxy)-3-pyrrolidin-1-ylpropan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.