1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester
TL;DR: 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester (CAS 83938-06-1) is a chemical compound with molecular formula C15H13ClO2 and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-chlorophenyl)benzoate
Also Known As: ethyl 4-(2-chlorophenyl)benzoate, RARECHEMALBI1241, Ethyl 2'-chloro-1,1'-biphenyl-4-carboxylate, Chloro-2' biphenyl-4 carboxylate d'ethyle, 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester
| Molecular Formula | C15H13ClO2 |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 4.1837 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.0604 |
| Heavy Atoms | 18 |
| Complexity | 546.675 |
Chemical Identifiers
| CAS Number | 83938-06-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)C2=CC=CC=C2Cl |
Product Overview
1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester (CAS 83938-06-1), with molecular formula C15H13ClO2 and molecular weight 260.06 g/mol. IUPAC: ethyl 4-(2-chlorophenyl)benzoate.
Chemical Property Profile of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester
Property Insights of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester
The XLogP value of 4.1837 indicates that 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester has 0 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 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester?
The CAS number of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester is 83938-06-1.
What is the molecular formula of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester?
The molecular formula of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester is C15H13ClO2.
What is the molecular weight of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester?
The molecular weight of 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester is 260.06 g/mol.
Where can I buy 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester?
You can request a quote for 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Biphenyl-4-carboxylic acid, 2'-chloro-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.