Benzyl o-chlorophenyl ether
TL;DR: Benzyl o-chlorophenyl ether (CAS 949-38-2) is a chemical compound with molecular formula C13H11ClO and molecular weight 218.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-phenylmethoxybenzene
Also Known As: 1-(Benzyloxy)-2-chlorobenzene, Benzyl 2-chlorophenyl ether, BENZYL O-CHLOROPHENYL ETHER, Ether, benzyl o-chlorophenyl-, Benzene, 1-chloro-2-(phenylmethoxy)-
| Molecular Formula | C13H11ClO |
|---|---|
| Molecular Weight | 218.05 g/mol |
| LogP | 3.919 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.04984 |
| Heavy Atoms | 15 |
| Complexity | 425.5609 |
Chemical Identifiers
| CAS Number | 949-38-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=CC=C2Cl |
Product Overview
Benzyl o-chlorophenyl ether (CAS 949-38-2), with molecular formula C13H11ClO and molecular weight 218.05 g/mol. IUPAC: 1-chloro-2-phenylmethoxybenzene.
Chemical Property Profile of Benzyl o-chlorophenyl ether
Property Insights of Benzyl o-chlorophenyl ether
The XLogP value of 3.919 indicates that Benzyl o-chlorophenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, Benzyl o-chlorophenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl o-chlorophenyl ether has 0 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 Benzyl o-chlorophenyl ether?
The CAS number of Benzyl o-chlorophenyl ether is 949-38-2.
What is the molecular formula of Benzyl o-chlorophenyl ether?
The molecular formula of Benzyl o-chlorophenyl ether is C13H11ClO.
What is the molecular weight of Benzyl o-chlorophenyl ether?
The molecular weight of Benzyl o-chlorophenyl ether is 218.05 g/mol.
Where can I buy Benzyl o-chlorophenyl ether?
You can request a quote for Benzyl o-chlorophenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl o-chlorophenyl ether?
Yes, KEHONG BIO provides custom synthesis services for Benzyl o-chlorophenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.