(5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid
TL;DR: (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid (CAS 35033-79-5) is a chemical compound with molecular formula C20H20O3 and molecular weight 308.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,5S)-2-benzoyl-5-phenylcyclohexane-1-carboxylic acid
Also Known As: 2-TRANS-BENZOYL-5-TRANS-PHENYL, 5-Phenyl-2-benzoylcyclohexan-1-carbonsaeure, J1.312.984C, 2-TRANS-BENZOYL-5-TRANS-PHENYL-1-CYCLOHEXANECARBOXYLIC ACID, (1R,2R,5S)-2-benzoyl-5-phenylcyclohexane-1-carboxylic acid
| Molecular Formula | C20H20O3 |
|---|---|
| Molecular Weight | 308.14 g/mol |
| LogP | 4.154 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.14124 |
| Heavy Atoms | 23 |
| Complexity | 678.54767 |
Chemical Identifiers
| CAS Number | 35033-79-5 |
|---|---|
| SMILES | C1C[C@H]([C@@H](C[C@H]1C2=CC=CC=C2)C(=O)O)C(=O)C3=CC=CC=C3 |
Product Overview
(5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid (CAS 35033-79-5), with molecular formula C20H20O3 and molecular weight 308.14 g/mol. IUPAC: (1R,2R,5S)-2-benzoyl-5-phenylcyclohexane-1-carboxylic acid.
Chemical Property Profile of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid
Property Insights of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid
The XLogP value of 4.154 indicates that (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic 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, (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic 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 (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid?
The CAS number of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid is 35033-79-5.
What is the molecular formula of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid?
The molecular formula of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid is C20H20O3.
What is the molecular weight of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid?
The molecular weight of (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid is 308.14 g/mol.
Where can I buy (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid?
You can request a quote for (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (5S,1R,2R)-5-phenyl-2-(phenylcarbonyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.