Octanoic acid, 4-formylphenyl ester
TL;DR: Octanoic acid, 4-formylphenyl ester (CAS 50433-83-5) is a chemical compound with molecular formula C15H20O3 and molecular weight 248.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-formylphenyl) octanoate
Also Known As: 4-formylphenyl octanoate, (4-formylphenyl) Octanoate, Octanoic acid, 4-formylphenyl ester, (4-formylphenyl)octanoate, 4-formylphenyloctanoate
| Molecular Formula | C15H20O3 |
|---|---|
| Molecular Weight | 248.14 g/mol |
| LogP | 3.765 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 248.14125 |
| Heavy Atoms | 18 |
| Complexity | 367.83005 |
Chemical Identifiers
| CAS Number | 50433-83-5 |
|---|---|
| SMILES | CCCCCCCC(=O)OC1=CC=C(C=C1)C=O |
Product Overview
Octanoic acid, 4-formylphenyl ester (CAS 50433-83-5), with molecular formula C15H20O3 and molecular weight 248.14 g/mol. IUPAC: (4-formylphenyl) octanoate.
Chemical Property Profile of Octanoic acid, 4-formylphenyl ester
Property Insights of Octanoic acid, 4-formylphenyl ester
The XLogP value of 3.765 indicates that Octanoic acid, 4-formylphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Octanoic acid, 4-formylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octanoic acid, 4-formylphenyl ester has 0 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 Octanoic acid, 4-formylphenyl ester?
The CAS number of Octanoic acid, 4-formylphenyl ester is 50433-83-5.
What is the molecular formula of Octanoic acid, 4-formylphenyl ester?
The molecular formula of Octanoic acid, 4-formylphenyl ester is C15H20O3.
What is the molecular weight of Octanoic acid, 4-formylphenyl ester?
The molecular weight of Octanoic acid, 4-formylphenyl ester is 248.14 g/mol.
Where can I buy Octanoic acid, 4-formylphenyl ester?
You can request a quote for Octanoic acid, 4-formylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octanoic acid, 4-formylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Octanoic acid, 4-formylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.