2-氟丁酸
TL;DR: 2-氟丁酸 (CAS 433-44-3) is a chemical compound with molecular formula C4H7FO2 and molecular weight 106.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氟丁酸
2-fluorobutanoic acid
Also Known As: 2-fluorobutanoic acid, 2-Fluorobutyric acid, fluorobutyric acid, alpha-Fluorobutanoic acid, 2-fluorobutanoicacid
| Molecular Formula | C4H7FO2 |
|---|---|
| Molecular Weight | 106.04 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 106.04301 |
| Heavy Atoms | 7 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 433-44-3 |
|---|---|
| SMILES | CCC(C(=O)O)F |
| InChIKey | GCSPSGQVZXMPKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氟丁酸 (CAS 433-44-3), with molecular formula C4H7FO2 and molecular weight 106.04 g/mol. IUPAC: 2-fluorobutanoic acid.
Chemical Property Profile of 2-氟丁酸
Property Insights of 2-氟丁酸
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氟丁酸. With a topological polar surface area (TPSA) of 37.3 Ų, 2-氟丁酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氟丁酸 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 2-氟丁酸?
The CAS number of 2-氟丁酸 is 433-44-3.
What is the molecular formula of 2-氟丁酸?
The molecular formula of 2-氟丁酸 is C4H7FO2.
What is the molecular weight of 2-氟丁酸?
The molecular weight of 2-氟丁酸 is 106.04 g/mol.
Where can I buy 2-氟丁酸?
You can request a quote for 2-氟丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氟丁酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氟丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.