4-(2,2-Dichlorocyclopropyl)benzoic acid
TL;DR: 4-(2,2-Dichlorocyclopropyl)benzoic acid (CAS 3761-93-1) is a chemical compound with molecular formula C10H8Cl2O2 and molecular weight 229.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,2-dichlorocyclopropyl)benzoic acid
Also Known As: 4-(2,2-dichlorocyclopropyl)benzoic acid, Benzoic acid, 4-(2,2-dichlorocyclopropyl)-, 4-(2,2-Dichloro-cyclopropyl)-benzoic acid, A3252/0138203, 873-891-4
| Molecular Formula | C10H8Cl2O2 |
|---|---|
| Molecular Weight | 229.99 g/mol |
| LogP | 3.046 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.99013 |
| Heavy Atoms | 14 |
| Complexity | 370.21332 |
Chemical Identifiers
| CAS Number | 3761-93-1 |
|---|---|
| SMILES | C1C(C1(Cl)Cl)C2=CC=C(C=C2)C(=O)O |
Product Overview
4-(2,2-Dichlorocyclopropyl)benzoic acid (CAS 3761-93-1), with molecular formula C10H8Cl2O2 and molecular weight 229.99 g/mol. IUPAC: 4-(2,2-dichlorocyclopropyl)benzoic acid.
Chemical Property Profile of 4-(2,2-Dichlorocyclopropyl)benzoic acid
Property Insights of 4-(2,2-Dichlorocyclopropyl)benzoic acid
The XLogP value of 3.046 indicates that 4-(2,2-Dichlorocyclopropyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(2,2-Dichlorocyclopropyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2,2-Dichlorocyclopropyl)benzoic acid has 1 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 4-(2,2-Dichlorocyclopropyl)benzoic acid?
The CAS number of 4-(2,2-Dichlorocyclopropyl)benzoic acid is 3761-93-1.
What is the molecular formula of 4-(2,2-Dichlorocyclopropyl)benzoic acid?
The molecular formula of 4-(2,2-Dichlorocyclopropyl)benzoic acid is C10H8Cl2O2.
What is the molecular weight of 4-(2,2-Dichlorocyclopropyl)benzoic acid?
The molecular weight of 4-(2,2-Dichlorocyclopropyl)benzoic acid is 229.99 g/mol.
Where can I buy 4-(2,2-Dichlorocyclopropyl)benzoic acid?
You can request a quote for 4-(2,2-Dichlorocyclopropyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2,2-Dichlorocyclopropyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,2-Dichlorocyclopropyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.