2-Chlorocyclohex-1-ene-1-carboxylic acid
TL;DR: 2-Chlorocyclohex-1-ene-1-carboxylic acid (CAS 56475-13-9) is a chemical compound with molecular formula C7H9ClO2 and molecular weight 160.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chlorocyclohexene-1-carboxylic acid
Also Known As: 2-chlorocyclohex-1-ene-1-carboxylic acid, 2-chlorocyclohexene-1-carboxylic Acid, 1-Carboxy-2-chlorcyclohexen, 2-Chlorocyclohex-1-enecarboxylic acid, 2-Chloro-1-cyclohexenecarboxylic Acid
| Molecular Formula | C7H9ClO2 |
|---|---|
| Molecular Weight | 160.03 g/mol |
| LogP | 2.1379 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.02911 |
| Heavy Atoms | 10 |
| Complexity | 184.04514 |
Chemical Identifiers
| CAS Number | 56475-13-9 |
|---|---|
| SMILES | C1CCC(=C(C1)C(=O)O)Cl |
Product Overview
2-Chlorocyclohex-1-ene-1-carboxylic acid (CAS 56475-13-9), with molecular formula C7H9ClO2 and molecular weight 160.03 g/mol. IUPAC: 2-chlorocyclohexene-1-carboxylic acid.
Chemical Property Profile of 2-Chlorocyclohex-1-ene-1-carboxylic acid
Property Insights of 2-Chlorocyclohex-1-ene-1-carboxylic acid
The XLogP value of 2.1379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chlorocyclohex-1-ene-1-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Chlorocyclohex-1-ene-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorocyclohex-1-ene-1-carboxylic 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 2-Chlorocyclohex-1-ene-1-carboxylic acid?
The CAS number of 2-Chlorocyclohex-1-ene-1-carboxylic acid is 56475-13-9.
What is the molecular formula of 2-Chlorocyclohex-1-ene-1-carboxylic acid?
The molecular formula of 2-Chlorocyclohex-1-ene-1-carboxylic acid is C7H9ClO2.
What is the molecular weight of 2-Chlorocyclohex-1-ene-1-carboxylic acid?
The molecular weight of 2-Chlorocyclohex-1-ene-1-carboxylic acid is 160.03 g/mol.
Where can I buy 2-Chlorocyclohex-1-ene-1-carboxylic acid?
You can request a quote for 2-Chlorocyclohex-1-ene-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-Chlorocyclohex-1-ene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorocyclohex-1-ene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.