(4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid
TL;DR: (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid (CAS 38817-29-7) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(pyrrolidin-1-ylmethyl)phenoxy]acetic acid
Also Known As: (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid, 5-fluoro-5'-deoxyuridine, ASN 09646817, 2-[4-(pyrrolidin-1-ylmethyl)phenoxy]acetic acid, 4-(pyrrolidin-1-ylmethyl)phenoxyacetic acid
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.7458 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 368.7559 |
Chemical Identifiers
| CAS Number | 38817-29-7 |
|---|---|
| SMILES | C1CCN(C1)CC2=CC=C(C=C2)OCC(=O)O |
Product Overview
(4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid (CAS 38817-29-7), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: 2-[4-(pyrrolidin-1-ylmethyl)phenoxy]acetic acid.
Chemical Property Profile of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid
Property Insights of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid
The XLogP value of 1.7458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid. With a topological polar surface area (TPSA) of 49.77 Ų, (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid 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 (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid?
The CAS number of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid is 38817-29-7.
What is the molecular formula of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid?
The molecular formula of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid is C13H17NO3.
What is the molecular weight of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid?
The molecular weight of (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid is 235.12 g/mol.
Where can I buy (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid?
You can request a quote for (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-Pyrrolidin-1-ylmethyl-phenoxy)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.