Fluoro-beta-alanine hydrochloride
TL;DR: Fluoro-beta-alanine hydrochloride (CAS 867-84-5) is a chemical compound with molecular formula C3H7ClFNO2 and molecular weight 143.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-carboxy-2-fluoroethyl)azanium chloride
Also Known As: Fluoro-beta-alanine hydrochloride, (2-carboxy-2-fluoroethyl)azanium;chloride, 2-carboxy-2-fluoroethanaminium chloride, beta-ALANINE, 2-FLUORO-, HYDROCHLORIDE, Propanoic acid, 3-amino-2-fluoro-, hydrochloride
| Molecular Formula | C3H7ClFNO2 |
|---|---|
| Molecular Weight | 143.01 g/mol |
| LogP | -4.34 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 143.01494 |
| Heavy Atoms | 8 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 867-84-5 |
|---|---|
| SMILES | C(C(C(=O)O)F)[NH3+].[Cl-] |
| InChIKey | CVYOZQFAVJXJTK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fluoro-beta-alanine hydrochloride (CAS 867-84-5), with molecular formula C3H7ClFNO2 and molecular weight 143.01 g/mol. IUPAC: (2-carboxy-2-fluoroethyl)azanium chloride.
Chemical Property Profile of Fluoro-beta-alanine hydrochloride
Property Insights of Fluoro-beta-alanine hydrochloride
The XLogP value of -4.34 indicates that Fluoro-beta-alanine hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluoro-beta-alanine hydrochloride. Following Lipinski's Rule of Five, Fluoro-beta-alanine hydrochloride has 2 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 Fluoro-beta-alanine hydrochloride?
The CAS number of Fluoro-beta-alanine hydrochloride is 867-84-5.
What is the molecular formula of Fluoro-beta-alanine hydrochloride?
The molecular formula of Fluoro-beta-alanine hydrochloride is C3H7ClFNO2.
What is the molecular weight of Fluoro-beta-alanine hydrochloride?
The molecular weight of Fluoro-beta-alanine hydrochloride is 143.01 g/mol.
Where can I buy Fluoro-beta-alanine hydrochloride?
You can request a quote for Fluoro-beta-alanine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluoro-beta-alanine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Fluoro-beta-alanine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.