2-Chlorophenyl cyclohexanecarboxylate
TL;DR: 2-Chlorophenyl cyclohexanecarboxylate (CAS 101068-39-7) is a chemical compound with molecular formula C13H15ClO2 and molecular weight 238.07605 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-chlorophenyl) cyclohexanecarboxylate
Also Known As: 2-Chlorophenyl cyclohexanecarboxylate, (2-chlorophenyl) cyclohexanecarboxylate, Cyclohexanecarboxylic acid, 2-chlorophenyl ester, 2-Chlorophenyl cyclohexanecarboxylate #, F3098-7525
Technical Specifications
| Molecular Formula | C13H15ClO2 |
| Molecular Weight | 238.07605 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.07605 Da |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
| SMILES | C1CCC(CC1)C(=O)OC2=CC=CC=C2Cl |
| InChIKey | CVAIHALBNQCWTA-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chlorophenyl cyclohexanecarboxylate
Property Insights of 2-Chlorophenyl cyclohexanecarboxylate
The XLogP value of 4.3 indicates that 2-Chlorophenyl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Chlorophenyl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorophenyl cyclohexanecarboxylate 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
What is the CAS number of 2-Chlorophenyl cyclohexanecarboxylate?
The CAS number of 2-Chlorophenyl cyclohexanecarboxylate is 101068-39-7.
What is the molecular formula of 2-Chlorophenyl cyclohexanecarboxylate?
The molecular formula of 2-Chlorophenyl cyclohexanecarboxylate is C13H15ClO2.
What is the molecular weight of 2-Chlorophenyl cyclohexanecarboxylate?
The molecular weight of 2-Chlorophenyl cyclohexanecarboxylate is 238.07605 g/mol.
Where can I buy 2-Chlorophenyl cyclohexanecarboxylate?
You can request a quote for 2-Chlorophenyl cyclohexanecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chlorophenyl cyclohexanecarboxylate?
Yes, CoreyChem provides custom synthesis services for 2-Chlorophenyl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.