3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid
TL;DR: 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid (CAS 86271-58-1) is a chemical compound with molecular formula C20H23ClO4 and molecular weight 362.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(3-chloro-4-propan-2-yloxyphenyl)methoxy]phenyl]butanoic acid
Also Known As: 3-(4-((3-CHLORO-4-ISOPROPOXYBENZYL)OXY)PHENYL)BUTANOIC ACID, 3-[4-({3-Chloro-4-[(propan-2-yl)oxy]phenyl}methoxy)phenyl]butanoic acid, 3-[4-[(3-chloro-4-propan-2-yloxy-phenyl)methoxy]phenyl]butanoic Acid, 3-[4-[(3-chloro-4-propan-2-yloxyphenyl)methoxy]phenyl]butanoic acid, 4-[[3-Chloro-4-(1-methylethoxy)phenyl]methoxy]-I(2)-methylbenzenepropanoic acid
| Molecular Formula | C20H23ClO4 |
|---|---|
| Molecular Weight | 362.13 g/mol |
| LogP | 5.2844 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.12848 |
| Heavy Atoms | 25 |
| Complexity | 710.1361 |
Chemical Identifiers
| CAS Number | 86271-58-1 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C=C1)COC2=CC=C(C=C2)C(C)CC(=O)O)Cl |
Product Overview
3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid (CAS 86271-58-1), with molecular formula C20H23ClO4 and molecular weight 362.13 g/mol. IUPAC: 3-[4-[(3-chloro-4-propan-2-yloxyphenyl)methoxy]phenyl]butanoic acid.
Chemical Property Profile of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid
Property Insights of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid
The XLogP value of 5.2844 indicates that 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid?
The CAS number of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid is 86271-58-1.
What is the molecular formula of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid?
The molecular formula of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid is C20H23ClO4.
What is the molecular weight of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid?
The molecular weight of 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid is 362.13 g/mol.
Where can I buy 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid?
You can request a quote for 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-((3-Chloro-4-isopropoxybenzyl)oxy)phenyl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.