Acetic acid, 4-fluorobutyl ester
TL;DR: Acetic acid, 4-fluorobutyl ester (CAS 373-09-1) is a chemical compound with molecular formula C6H11FO2 and molecular weight 134.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluorobutyl acetate
Also Known As: 4-Fluorobutyl acetate, 4-Fluorobutyl=acetate, ACETIC ACID, 4-FLUOROBUTYL ESTER, PYRIDOXAMINE-5'-PHOSPHATE, acetic acid-(4-fluoro-butyl ester)
| Molecular Formula | C6H11FO2 |
|---|---|
| Molecular Weight | 134.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 134.07431 |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 373-09-1 |
|---|---|
| SMILES | CC(=O)OCCCCF |
| InChIKey | APLJRWZEMBRHHT-UHFFFAOYSA-N |
Product Overview
Acetic acid, 4-fluorobutyl ester (CAS 373-09-1), with molecular formula C6H11FO2 and molecular weight 134.07 g/mol. IUPAC: 4-fluorobutyl acetate.
Chemical Property Profile of Acetic acid, 4-fluorobutyl ester
Property Insights of Acetic acid, 4-fluorobutyl ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 4-fluorobutyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Acetic acid, 4-fluorobutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, 4-fluorobutyl 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 Acetic acid, 4-fluorobutyl ester?
The CAS number of Acetic acid, 4-fluorobutyl ester is 373-09-1.
What is the molecular formula of Acetic acid, 4-fluorobutyl ester?
The molecular formula of Acetic acid, 4-fluorobutyl ester is C6H11FO2.
What is the molecular weight of Acetic acid, 4-fluorobutyl ester?
The molecular weight of Acetic acid, 4-fluorobutyl ester is 134.07 g/mol.
Where can I buy Acetic acid, 4-fluorobutyl ester?
You can request a quote for Acetic acid, 4-fluorobutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 4-fluorobutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 4-fluorobutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.