1-(4-Fluorobenzyl)azetidine-2-carboxylic acid
TL;DR: 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid (CAS 1042414-89-0) is a chemical compound with molecular formula C11H12FNO2 and molecular weight 209.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]azetidine-2-carboxylic acid
Also Known As: 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid, Cyclohexanone,dimethylhydrazone, 1-[(4-fluorophenyl)methyl]azetidine-2-carboxylic Acid, 1-(4-Fluorobenzyl)azetidine-2-carboxylicacid, 1-(4-FLUORO-BENZYL)-AZETIDINE-2-CARBOXYLIC ACID
| Molecular Formula | C11H12FNO2 |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 1.4846 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.0852 |
| Heavy Atoms | 15 |
| Complexity | 363.3556 |
Chemical Identifiers
| CAS Number | 1042414-89-0 |
|---|---|
| SMILES | C1CN(C1C(=O)O)CC2=CC=C(C=C2)F |
Product Overview
1-(4-Fluorobenzyl)azetidine-2-carboxylic acid (CAS 1042414-89-0), with molecular formula C11H12FNO2 and molecular weight 209.09 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]azetidine-2-carboxylic acid.
Chemical Property Profile of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid
Property Insights of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid
The XLogP value of 1.4846 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid. With a topological polar surface area (TPSA) of 40.54 Ų, 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid has 1 hydrogen bond donor(s) and 2 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 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid?
The CAS number of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid is 1042414-89-0.
What is the molecular formula of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid?
The molecular formula of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid is C11H12FNO2.
What is the molecular weight of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid?
The molecular weight of 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid is 209.09 g/mol.
Where can I buy 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid?
You can request a quote for 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorobenzyl)azetidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.