Benzoic acid, 4-methoxy-, 2-chlorophenyl ester
TL;DR: Benzoic acid, 4-methoxy-, 2-chlorophenyl ester (CAS 7465-89-6) is a chemical compound with molecular formula C14H11ClO3 and molecular weight 262.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl) 4-methoxybenzoate
Also Known As: 2-Chlorophenyl 4-methoxybenzoate, (2-chlorophenyl) 4-methoxybenzoate, p-Anisic aid, o-chlorophenyl ester, NIOSH/DH3530750, (2-chlorophenyl)4-methoxybenzoate
| Molecular Formula | C14H11ClO3 |
|---|---|
| Molecular Weight | 262.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.03967 |
| Heavy Atoms | 18 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 7465-89-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2Cl |
| InChIKey | GQOTVEHMQKIPGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 4-methoxy-, 2-chlorophenyl ester (CAS 7465-89-6), with molecular formula C14H11ClO3 and molecular weight 262.04 g/mol. IUPAC: (2-chlorophenyl) 4-methoxybenzoate.
Chemical Property Profile of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester
Property Insights of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester
The XLogP value of 3.8 indicates that Benzoic acid, 4-methoxy-, 2-chlorophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Benzoic acid, 4-methoxy-, 2-chlorophenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-methoxy-, 2-chlorophenyl ester 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 Benzoic acid, 4-methoxy-, 2-chlorophenyl ester?
The CAS number of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester is 7465-89-6.
What is the molecular formula of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester?
The molecular formula of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester is C14H11ClO3.
What is the molecular weight of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester?
The molecular weight of Benzoic acid, 4-methoxy-, 2-chlorophenyl ester is 262.04 g/mol.
Where can I buy Benzoic acid, 4-methoxy-, 2-chlorophenyl ester?
You can request a quote for Benzoic acid, 4-methoxy-, 2-chlorophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-methoxy-, 2-chlorophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-methoxy-, 2-chlorophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.