4-Fluorobenzylguanidine
TL;DR: 4-Fluorobenzylguanidine (CAS 459-33-6) is a chemical compound with molecular formula C8H10FN3 and molecular weight 167.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methyl]guanidine
Also Known As: 1-(4-Fluorobenzyl)Guanidine, 4-Fluorobenzylguanidine, 2-[(4-fluorophenyl)methyl]guanidine, p-Fluorobenzylguanidine, parafluorobenzylguanidine
| Molecular Formula | C8H10FN3 |
|---|---|
| Molecular Weight | 167.09 g/mol |
| LogP | 0.5991 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.08588 |
| Heavy Atoms | 12 |
| Complexity | 274.85938 |
Chemical Identifiers
| CAS Number | 459-33-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CN=C(N)N)F |
Product Overview
4-Fluorobenzylguanidine (CAS 459-33-6), with molecular formula C8H10FN3 and molecular weight 167.09 g/mol. IUPAC: 2-[(4-fluorophenyl)methyl]guanidine.
Chemical Property Profile of 4-Fluorobenzylguanidine
Property Insights of 4-Fluorobenzylguanidine
The XLogP value of 0.5991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorobenzylguanidine. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Fluorobenzylguanidine. Following Lipinski's Rule of Five, 4-Fluorobenzylguanidine has 2 hydrogen bond donor(s) and 1 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 4-Fluorobenzylguanidine?
The CAS number of 4-Fluorobenzylguanidine is 459-33-6.
What is the molecular formula of 4-Fluorobenzylguanidine?
The molecular formula of 4-Fluorobenzylguanidine is C8H10FN3.
What is the molecular weight of 4-Fluorobenzylguanidine?
The molecular weight of 4-Fluorobenzylguanidine is 167.09 g/mol.
Where can I buy 4-Fluorobenzylguanidine?
You can request a quote for 4-Fluorobenzylguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorobenzylguanidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorobenzylguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.