2-Bromo-3-fluoropropanoic acid
TL;DR: 2-Bromo-3-fluoropropanoic acid (CAS 16652-36-1) is a chemical compound with molecular formula C3H4BrFO2 and molecular weight 169.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-3-fluoropropanoic acid
Also Known As: 2-bromo-3-fluoropropanoic acid, 2-BROMO-3-FLUOROPROPIONIC ACID, Propanoic acid, 2-bromo-3-fluoro-, 2-Bromo-3-fluoropropionicacid, 2-bromo-3-fluoro-propanoic acid
| Molecular Formula | C3H4BrFO2 |
|---|---|
| Molecular Weight | 169.94 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.93787 |
| Heavy Atoms | 7 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 16652-36-1 |
|---|---|
| SMILES | C(C(C(=O)O)Br)F |
| InChIKey | FBPUCVAAEPPEMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-3-fluoropropanoic acid (CAS 16652-36-1), with molecular formula C3H4BrFO2 and molecular weight 169.94 g/mol. IUPAC: 2-bromo-3-fluoropropanoic acid.
Chemical Property Profile of 2-Bromo-3-fluoropropanoic acid
Property Insights of 2-Bromo-3-fluoropropanoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-3-fluoropropanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Bromo-3-fluoropropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-3-fluoropropanoic acid 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-Bromo-3-fluoropropanoic acid?
The CAS number of 2-Bromo-3-fluoropropanoic acid is 16652-36-1.
What is the molecular formula of 2-Bromo-3-fluoropropanoic acid?
The molecular formula of 2-Bromo-3-fluoropropanoic acid is C3H4BrFO2.
What is the molecular weight of 2-Bromo-3-fluoropropanoic acid?
The molecular weight of 2-Bromo-3-fluoropropanoic acid is 169.94 g/mol.
Where can I buy 2-Bromo-3-fluoropropanoic acid?
You can request a quote for 2-Bromo-3-fluoropropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-3-fluoropropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-3-fluoropropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.