2-Chlorophenyl 3-chloro-4-methoxybenzoate
TL;DR: 2-Chlorophenyl 3-chloro-4-methoxybenzoate (CAS 836664-33-6) is a chemical compound with molecular formula C14H10Cl2O3 and molecular weight 296.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl) 3-chloro-4-methoxybenzoate
Also Known As: 2-chlorophenyl 3-chloro-4-methoxybenzoate, (2-chlorophenyl) 3-chloro-4-methoxybenzoate
| Molecular Formula | C14H10Cl2O3 |
|---|---|
| Molecular Weight | 296.00 g/mol |
| LogP | 4.2212 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.0007 |
| Heavy Atoms | 19 |
| Complexity | 611.39014 |
Chemical Identifiers
| CAS Number | 836664-33-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2Cl)Cl |
Product Overview
2-Chlorophenyl 3-chloro-4-methoxybenzoate (CAS 836664-33-6), with molecular formula C14H10Cl2O3 and molecular weight 296.00 g/mol. IUPAC: (2-chlorophenyl) 3-chloro-4-methoxybenzoate.
Chemical Property Profile of 2-Chlorophenyl 3-chloro-4-methoxybenzoate
Property Insights of 2-Chlorophenyl 3-chloro-4-methoxybenzoate
The XLogP value of 4.2212 indicates that 2-Chlorophenyl 3-chloro-4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 2-Chlorophenyl 3-chloro-4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorophenyl 3-chloro-4-methoxybenzoate has 0 hydrogen bond donor(s) and 3 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-Chlorophenyl 3-chloro-4-methoxybenzoate?
The CAS number of 2-Chlorophenyl 3-chloro-4-methoxybenzoate is 836664-33-6.
What is the molecular formula of 2-Chlorophenyl 3-chloro-4-methoxybenzoate?
The molecular formula of 2-Chlorophenyl 3-chloro-4-methoxybenzoate is C14H10Cl2O3.
What is the molecular weight of 2-Chlorophenyl 3-chloro-4-methoxybenzoate?
The molecular weight of 2-Chlorophenyl 3-chloro-4-methoxybenzoate is 296.00 g/mol.
Where can I buy 2-Chlorophenyl 3-chloro-4-methoxybenzoate?
You can request a quote for 2-Chlorophenyl 3-chloro-4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorophenyl 3-chloro-4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorophenyl 3-chloro-4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.