2-(2-Chlorobenzyl)thiophene
TL;DR: 2-(2-Chlorobenzyl)thiophene (CAS 91968-83-1) is a chemical compound with molecular formula C11H9ClS and molecular weight 208.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chlorophenyl)methyl]thiophene
Also Known As: 2-(2-chlorobenzyl)thiophene, 2-[(2-chlorophenyl)methyl]thiophene, 2-<2-Chlor-benzyl>-thiophen, 2-(2-chloro-benzyl)-thiophene
| Molecular Formula | C11H9ClS |
|---|---|
| Molecular Weight | 208.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.01135 |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 91968-83-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC2=CC=CS2)Cl |
| InChIKey | XTTKYSPRJPOHGO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Chlorobenzyl)thiophene (CAS 91968-83-1), with molecular formula C11H9ClS and molecular weight 208.01 g/mol. IUPAC: 2-[(2-chlorophenyl)methyl]thiophene.
Chemical Property Profile of 2-(2-Chlorobenzyl)thiophene
Property Insights of 2-(2-Chlorobenzyl)thiophene
The XLogP value of 4.2 indicates that 2-(2-Chlorobenzyl)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 2-(2-Chlorobenzyl)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chlorobenzyl)thiophene 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 2-(2-Chlorobenzyl)thiophene?
The CAS number of 2-(2-Chlorobenzyl)thiophene is 91968-83-1.
What is the molecular formula of 2-(2-Chlorobenzyl)thiophene?
The molecular formula of 2-(2-Chlorobenzyl)thiophene is C11H9ClS.
What is the molecular weight of 2-(2-Chlorobenzyl)thiophene?
The molecular weight of 2-(2-Chlorobenzyl)thiophene is 208.01 g/mol.
Where can I buy 2-(2-Chlorobenzyl)thiophene?
You can request a quote for 2-(2-Chlorobenzyl)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chlorobenzyl)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chlorobenzyl)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.