Butyl 3-fluoro-2-hydroxypropanoate
TL;DR: Butyl 3-fluoro-2-hydroxypropanoate (CAS 6918-20-3) is a chemical compound with molecular formula C7H13FO3 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 3-fluoro-2-hydroxypropanoate
Also Known As: butyl 3-fluoro-2-hydroxypropanoate, Propanoicacid,3-fluoro-2-hydroxy-,butylester, Propanoic acid,3-fluoro-2-hydroxy-, butyl ester, Propanoic acid, 3-fluoro-2-hydroxy-, butyl ester
| Molecular Formula | C7H13FO3 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 164.08487 |
| Heavy Atoms | 11 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 6918-20-3 |
|---|---|
| SMILES | CCCCOC(=O)C(CF)O |
| InChIKey | RBBWJRYTJUGTFY-UHFFFAOYSA-N |
Product Overview
Butyl 3-fluoro-2-hydroxypropanoate (CAS 6918-20-3), with molecular formula C7H13FO3 and molecular weight 164.08 g/mol. IUPAC: butyl 3-fluoro-2-hydroxypropanoate.
Chemical Property Profile of Butyl 3-fluoro-2-hydroxypropanoate
Property Insights of Butyl 3-fluoro-2-hydroxypropanoate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 3-fluoro-2-hydroxypropanoate. With a topological polar surface area (TPSA) of 46.5 Ų, Butyl 3-fluoro-2-hydroxypropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 3-fluoro-2-hydroxypropanoate 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 Butyl 3-fluoro-2-hydroxypropanoate?
The CAS number of Butyl 3-fluoro-2-hydroxypropanoate is 6918-20-3.
What is the molecular formula of Butyl 3-fluoro-2-hydroxypropanoate?
The molecular formula of Butyl 3-fluoro-2-hydroxypropanoate is C7H13FO3.
What is the molecular weight of Butyl 3-fluoro-2-hydroxypropanoate?
The molecular weight of Butyl 3-fluoro-2-hydroxypropanoate is 164.08 g/mol.
Where can I buy Butyl 3-fluoro-2-hydroxypropanoate?
You can request a quote for Butyl 3-fluoro-2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 3-fluoro-2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 3-fluoro-2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.