2-Chloro-4-fluorobenzylamine
TL;DR: 2-Chloro-4-fluorobenzylamine (CAS 89797-68-2) is a chemical compound with molecular formula C7H7ClFN and molecular weight 159.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-4-fluorophenyl)methanamine
Also Known As: 2-Chloro-4-fluorobenzylamine, 2-chloro-4-fluorobenzyl amine, (2-chloro-4-fluorophenyl)methanamine, 1-(2-chloro-4-fluorophenyl)methanamine, 2-Chloro-4-Florobenzylamine
| Molecular Formula | C7H7ClFN |
|---|---|
| Molecular Weight | 159.03 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.0251 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 89797-68-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)Cl)CN |
| InChIKey | CBKWAXKMZUULLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-4-fluorobenzylamine (CAS 89797-68-2), with molecular formula C7H7ClFN and molecular weight 159.03 g/mol. IUPAC: (2-chloro-4-fluorophenyl)methanamine.
Chemical Property Profile of 2-Chloro-4-fluorobenzylamine
Property Insights of 2-Chloro-4-fluorobenzylamine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4-fluorobenzylamine. With a topological polar surface area (TPSA) of 26.0 Ų, 2-Chloro-4-fluorobenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4-fluorobenzylamine 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 2-Chloro-4-fluorobenzylamine?
The CAS number of 2-Chloro-4-fluorobenzylamine is 89797-68-2.
What is the molecular formula of 2-Chloro-4-fluorobenzylamine?
The molecular formula of 2-Chloro-4-fluorobenzylamine is C7H7ClFN.
What is the molecular weight of 2-Chloro-4-fluorobenzylamine?
The molecular weight of 2-Chloro-4-fluorobenzylamine is 159.03 g/mol.
Where can I buy 2-Chloro-4-fluorobenzylamine?
You can request a quote for 2-Chloro-4-fluorobenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-fluorobenzylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-fluorobenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.