2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid
TL;DR: 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid (CAS 52034-99-8) is a chemical compound with molecular formula C7H7ClO2 and molecular weight 158.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloroethenyl)cyclobutene-1-carboxylic acid
Also Known As: 2-(2-chloroethenyl)cyclobutene-1-carboxylic acid, 2-[(E)-2-chloroethenyl]cyclobutene-1-carboxylic acid
| Molecular Formula | C7H7ClO2 |
|---|---|
| Molecular Weight | 158.01 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.01346 |
| Heavy Atoms | 10 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 52034-99-8 |
|---|---|
| SMILES | C1CC(=C1C=CCl)C(=O)O |
| InChIKey | BWMYZWVLQHRGKG-UHFFFAOYSA-N |
Product Overview
2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid (CAS 52034-99-8), with molecular formula C7H7ClO2 and molecular weight 158.01 g/mol. IUPAC: 2-(2-chloroethenyl)cyclobutene-1-carboxylic acid.
Chemical Property Profile of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid
Property Insights of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid has 1 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 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid?
The CAS number of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid is 52034-99-8.
What is the molecular formula of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid?
The molecular formula of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid is C7H7ClO2.
What is the molecular weight of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid?
The molecular weight of 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid is 158.01 g/mol.
Where can I buy 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid?
You can request a quote for 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroethenyl)cyclobutene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.