4-Benzyloxy-3-chloroaniline
TL;DR: 4-Benzyloxy-3-chloroaniline (CAS 144347-32-0) is a chemical compound with molecular formula C13H12ClNO and molecular weight 233.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-phenylmethoxyaniline
Also Known As: 4-Benzyloxy-3-chloroaniline, 4-(Benzyloxy)-3-chloroaniline, 3-chloro-4-phenylmethoxyaniline, Lapatinib Impurity 3, Lapatinib Impurity 14
| Molecular Formula | C13H12ClNO |
|---|---|
| Molecular Weight | 233.06 g/mol |
| LogP | 3.5012 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.06075 |
| Heavy Atoms | 16 |
| Complexity | 470.61374 |
Chemical Identifiers
| CAS Number | 144347-32-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)N)Cl |
Product Overview
4-Benzyloxy-3-chloroaniline (CAS 144347-32-0), with molecular formula C13H12ClNO and molecular weight 233.06 g/mol. IUPAC: 3-chloro-4-phenylmethoxyaniline.
Chemical Property Profile of 4-Benzyloxy-3-chloroaniline
Property Insights of 4-Benzyloxy-3-chloroaniline
The XLogP value of 3.5012 indicates that 4-Benzyloxy-3-chloroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.25 Ų, 4-Benzyloxy-3-chloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyloxy-3-chloroaniline 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 4-Benzyloxy-3-chloroaniline?
The CAS number of 4-Benzyloxy-3-chloroaniline is 144347-32-0.
What is the molecular formula of 4-Benzyloxy-3-chloroaniline?
The molecular formula of 4-Benzyloxy-3-chloroaniline is C13H12ClNO.
What is the molecular weight of 4-Benzyloxy-3-chloroaniline?
The molecular weight of 4-Benzyloxy-3-chloroaniline is 233.06 g/mol.
Where can I buy 4-Benzyloxy-3-chloroaniline?
You can request a quote for 4-Benzyloxy-3-chloroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyloxy-3-chloroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyloxy-3-chloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.