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alpha-Fluoro-beta-alanine structure
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alpha-Fluoro-beta-alanine

TL;DR: alpha-Fluoro-beta-alanine (CAS 3821-81-6) is a chemical compound with molecular formula C3H6FNO2 and molecular weight 107.03825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-amino-2-fluoropropanoic acid

Also Known As: 3-amino-2-fluoropropanoic acid, alpha-Fluoro-beta-alanine, dl-2-Fluoro-3-alanine, a-fluoro-b-alanine, 2-Fluoro-beta-alanine

CAS Number
3821-81-6
Molecular Formula
C3H6FNO2
Molecular Weight
107.03825 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Analytical Reagents (6 patents) Biotechnology (9 patents) Heterocyclic Building Blocks (38 patents) Organic Building Blocks (21 patents)

Technical Specifications

Molecular FormulaC3H6FNO2
Molecular Weight107.03825 g/mol
XLogP-3.0
Topological Polar Surface Area (TPSA)63.3 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass107.03825 Da
Heavy Atoms7
Complexity75.0
SMILESC(C(C(=O)O)F)N
InChIKeyOJQNRNQELNLWHH-UHFFFAOYSA-N

Chemical Property Profile of alpha-Fluoro-beta-alanine

XLogP
-3.0
TPSA (Topological Polar Surface Area)
63.3
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
7
Complexity
75.0
Exact Mass
107.03825
Monoisotopic Mass
107.03825
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of alpha-Fluoro-beta-alanine

The XLogP value of -3.0 indicates that alpha-Fluoro-beta-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Fluoro-beta-alanine. Following Lipinski's Rule of Five, alpha-Fluoro-beta-alanine 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

What is the CAS number of alpha-Fluoro-beta-alanine?

The CAS number of alpha-Fluoro-beta-alanine is 3821-81-6.

What is the molecular formula of alpha-Fluoro-beta-alanine?

The molecular formula of alpha-Fluoro-beta-alanine is C3H6FNO2.

What is the molecular weight of alpha-Fluoro-beta-alanine?

The molecular weight of alpha-Fluoro-beta-alanine is 107.03825 g/mol.

Where can I buy alpha-Fluoro-beta-alanine?

You can request a quote for alpha-Fluoro-beta-alanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for alpha-Fluoro-beta-alanine?

Yes, CoreyChem provides custom synthesis services for alpha-Fluoro-beta-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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