trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid
TL;DR: trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid (CAS 820991-07-9) is a chemical compound with molecular formula C14H15ClO3 and molecular weight 266.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,2R)-2-(4-chlorobenzoyl)cyclohexane-1-carboxylic acid
Also Known As: trans-2-(4-chlorobenzoyl)cyclohexane-1-carboxylic acid, (1R,2R)-2-(4-chlorobenzoyl)cyclohexane-1-carboxylic acid, 2-(4-chlorobenzoyl)cyclohexane-1-carboxylic Acid, cis-2-p-chlorobenzoyl-1-cyclohexanecarboxylic acid, TRANS-2- -1-CYCLOHEXANECARBOXYLICACID,98
| Molecular Formula | C14H15ClO3 |
|---|---|
| Molecular Weight | 266.07 g/mol |
| LogP | 3.4137 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.07098 |
| Heavy Atoms | 18 |
| Complexity | 452.61185 |
Chemical Identifiers
| CAS Number | 820991-07-9 |
|---|---|
| SMILES | C1CC[C@H]([C@@H](C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O |
Product Overview
trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid (CAS 820991-07-9), with molecular formula C14H15ClO3 and molecular weight 266.07 g/mol. IUPAC: trans-(1R,2R)-2-(4-chlorobenzoyl)cyclohexane-1-carboxylic acid.
Chemical Property Profile of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid
Property Insights of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid
The XLogP value of 3.4137 indicates that trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-2-(4-Chlorobenzoyl)cyclohexane-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 trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid?
The CAS number of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid is 820991-07-9.
What is the molecular formula of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid?
The molecular formula of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid is C14H15ClO3.
What is the molecular weight of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid?
The molecular weight of trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid is 266.07 g/mol.
Where can I buy trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid?
You can request a quote for trans-2-(4-Chlorobenzoyl)cyclohexane-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 trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for trans-2-(4-Chlorobenzoyl)cyclohexane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.