Methyl 4-butoxy-2-hydroxybenzoate
TL;DR: Methyl 4-butoxy-2-hydroxybenzoate (CAS 86840-96-2) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-butoxy-2-hydroxybenzoate
Also Known As: methyl 4-butoxy-2-hydroxybenzoate, methyl4-butoxy-2-hydroxybenzoate, Methyl 4-butoxy-2-hydroxy-benzoate, 2-Hydroxy-4-n-butoxybenzoesaeuremethylester
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 2.3577 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 360.03644 |
Chemical Identifiers
| CAS Number | 86840-96-2 |
|---|---|
| SMILES | CCCCOC1=CC(=C(C=C1)C(=O)OC)O |
Product Overview
Methyl 4-butoxy-2-hydroxybenzoate (CAS 86840-96-2), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: methyl 4-butoxy-2-hydroxybenzoate.
Chemical Property Profile of Methyl 4-butoxy-2-hydroxybenzoate
Property Insights of Methyl 4-butoxy-2-hydroxybenzoate
The XLogP value of 2.3577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-butoxy-2-hydroxybenzoate. With a topological polar surface area (TPSA) of 55.76 Ų, Methyl 4-butoxy-2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-butoxy-2-hydroxybenzoate has 1 hydrogen bond donor(s) and 4 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 Methyl 4-butoxy-2-hydroxybenzoate?
The CAS number of Methyl 4-butoxy-2-hydroxybenzoate is 86840-96-2.
What is the molecular formula of Methyl 4-butoxy-2-hydroxybenzoate?
The molecular formula of Methyl 4-butoxy-2-hydroxybenzoate is C12H16O4.
What is the molecular weight of Methyl 4-butoxy-2-hydroxybenzoate?
The molecular weight of Methyl 4-butoxy-2-hydroxybenzoate is 224.10 g/mol.
Where can I buy Methyl 4-butoxy-2-hydroxybenzoate?
You can request a quote for Methyl 4-butoxy-2-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-butoxy-2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-butoxy-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.