![[4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid structure](/static/products/101/101268-32-0.png)
[4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid
TL;DR: [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid (CAS 101268-32-0) is a chemical compound with molecular formula C13H18O4 and molecular weight 238.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-hydroxy-3-methylbutyl)phenoxy]acetic acid
Also Known As: [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid, 2-[4-(3-hydroxy-3-methylbutyl)phenoxy]acetic acid, 2-n-Amyloxy-3-methoxy-benzaldehyd, (4(3-hydroxy-3-methylbutyl)phenoxy)acetic acid, 4-(1',1'-Dimethyl-1'-hydroxypropyl)phenoxy-acetic acid
| Molecular Formula | C13H18O4 |
|---|---|
| Molecular Weight | 238.12 g/mol |
| LogP | 1.8535 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 238.12051 |
| Heavy Atoms | 17 |
| Complexity | 362.001 |
Chemical Identifiers
| CAS Number | 101268-32-0 |
|---|---|
| SMILES | CC(C)(CCC1=CC=C(C=C1)OCC(=O)O)O |
Product Overview
[4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid (CAS 101268-32-0), with molecular formula C13H18O4 and molecular weight 238.12 g/mol. IUPAC: 2-[4-(3-hydroxy-3-methylbutyl)phenoxy]acetic acid.
Chemical Property Profile of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid
Property Insights of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid
The XLogP value of 1.8535 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid. Following Lipinski's Rule of Five, [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid has 2 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-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid?
The CAS number of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid is 101268-32-0.
What is the molecular formula of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid?
The molecular formula of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid is C13H18O4.
What is the molecular weight of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid?
The molecular weight of [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid is 238.12 g/mol.
Where can I buy [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid?
You can request a quote for [4-(3-Hydroxy-3-methylbutyl)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-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [4-(3-Hydroxy-3-methylbutyl)phenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.