3-Chloro-4-(3-fluorobenzyloxy)aniline
TL;DR: 3-Chloro-4-(3-fluorobenzyloxy)aniline (CAS 202197-26-0) is a chemical compound with molecular formula C13H11ClFNO and molecular weight 251.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-[(3-fluorophenyl)methoxy]aniline
Also Known As: 3-CHLORO-4-(3-FLUOROBENZYLOXY)ANILINE, 3-Chloro-4-((3-fluorobenzyl)oxy)aniline, 3-chloro-4-[(3-fluorophenyl)methoxy]aniline, 3-chloro-4-[(3-fluorobenzyl)oxy]aniline, Lapatinib Impurity 1
| Molecular Formula | C13H11ClFNO |
|---|---|
| Molecular Weight | 251.05 g/mol |
| LogP | 3.6403 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.05132 |
| Heavy Atoms | 17 |
| Complexity | 530.57794 |
Chemical Identifiers
| CAS Number | 202197-26-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)N)Cl |
Product Overview
3-Chloro-4-(3-fluorobenzyloxy)aniline (CAS 202197-26-0), with molecular formula C13H11ClFNO and molecular weight 251.05 g/mol. IUPAC: 3-chloro-4-[(3-fluorophenyl)methoxy]aniline.
Chemical Property Profile of 3-Chloro-4-(3-fluorobenzyloxy)aniline
Property Insights of 3-Chloro-4-(3-fluorobenzyloxy)aniline
The XLogP value of 3.6403 indicates that 3-Chloro-4-(3-fluorobenzyloxy)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.25 Ų, 3-Chloro-4-(3-fluorobenzyloxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-(3-fluorobenzyloxy)aniline 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 3-Chloro-4-(3-fluorobenzyloxy)aniline?
The CAS number of 3-Chloro-4-(3-fluorobenzyloxy)aniline is 202197-26-0.
What is the molecular formula of 3-Chloro-4-(3-fluorobenzyloxy)aniline?
The molecular formula of 3-Chloro-4-(3-fluorobenzyloxy)aniline is C13H11ClFNO.
What is the molecular weight of 3-Chloro-4-(3-fluorobenzyloxy)aniline?
The molecular weight of 3-Chloro-4-(3-fluorobenzyloxy)aniline is 251.05 g/mol.
Where can I buy 3-Chloro-4-(3-fluorobenzyloxy)aniline?
You can request a quote for 3-Chloro-4-(3-fluorobenzyloxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-(3-fluorobenzyloxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-(3-fluorobenzyloxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.