[4-(But-2-en-1-yl)phenoxy]acetic acid
TL;DR: [4-(But-2-en-1-yl)phenoxy]acetic acid (CAS 7154-84-9) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-but-2-enylphenoxy)acetic acid
Also Known As: 2-(4-but-2-enylphenoxy)acetic acid, [4-(but-2-en-1-yl)phenoxy]acetic acid, 2-[4-(2-Buten-1-yl)phenoxy]acetic acid, 2-[4-[(E)-but-2-enyl]phenoxy]acetic acid
| Molecular Formula | C12H14O3 |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 206.0943 |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 7154-84-9 |
|---|---|
| SMILES | CC=CCC1=CC=C(C=C1)OCC(=O)O |
| InChIKey | OXIFLECLSFRBKV-UHFFFAOYSA-N |
Product Overview
[4-(But-2-en-1-yl)phenoxy]acetic acid (CAS 7154-84-9), with molecular formula C12H14O3 and molecular weight 206.09 g/mol. IUPAC: 2-(4-but-2-enylphenoxy)acetic acid.
Chemical Property Profile of [4-(But-2-en-1-yl)phenoxy]acetic acid
Property Insights of [4-(But-2-en-1-yl)phenoxy]acetic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(But-2-en-1-yl)phenoxy]acetic acid. With a topological polar surface area (TPSA) of 46.5 Ų, [4-(But-2-en-1-yl)phenoxy]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(But-2-en-1-yl)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-(But-2-en-1-yl)phenoxy]acetic acid?
The CAS number of [4-(But-2-en-1-yl)phenoxy]acetic acid is 7154-84-9.
What is the molecular formula of [4-(But-2-en-1-yl)phenoxy]acetic acid?
The molecular formula of [4-(But-2-en-1-yl)phenoxy]acetic acid is C12H14O3.
What is the molecular weight of [4-(But-2-en-1-yl)phenoxy]acetic acid?
The molecular weight of [4-(But-2-en-1-yl)phenoxy]acetic acid is 206.09 g/mol.
Where can I buy [4-(But-2-en-1-yl)phenoxy]acetic acid?
You can request a quote for [4-(But-2-en-1-yl)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-(But-2-en-1-yl)phenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [4-(But-2-en-1-yl)phenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.