(2-Phenylcyclohexyl) benzoate
TL;DR: (2-Phenylcyclohexyl) benzoate (CAS 129098-11-9) is a chemical compound with molecular formula C19H20O2 and molecular weight 280.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-phenylcyclohexyl) benzoate
Also Known As: (2-phenylcyclohexyl) benzoate, 2-Phenylcyclohexyl benzoate, NCIOpen2_003412, (1R,2S)-(-)-2-Phenylcyclohexyl benzoate, (1R,2S)-(-)-2-Phenylcyclohexanol benzoate
| Molecular Formula | C19H20O2 |
|---|---|
| Molecular Weight | 280.15 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.14633 |
| Heavy Atoms | 21 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 129098-11-9 |
|---|---|
| SMILES | C1CCC(C(C1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3 |
| InChIKey | PIVQGKOKGJKFFJ-UHFFFAOYSA-N |
Product Overview
(2-Phenylcyclohexyl) benzoate (CAS 129098-11-9), with molecular formula C19H20O2 and molecular weight 280.15 g/mol. IUPAC: (2-phenylcyclohexyl) benzoate.
Chemical Property Profile of (2-Phenylcyclohexyl) benzoate
Property Insights of (2-Phenylcyclohexyl) benzoate
The XLogP value of 5.0 indicates that (2-Phenylcyclohexyl) benzoate 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-Phenylcyclohexyl) benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Phenylcyclohexyl) benzoate 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
Frequently Asked Questions
What is the CAS number of (2-Phenylcyclohexyl) benzoate?
The CAS number of (2-Phenylcyclohexyl) benzoate is 129098-11-9.
What is the molecular formula of (2-Phenylcyclohexyl) benzoate?
The molecular formula of (2-Phenylcyclohexyl) benzoate is C19H20O2.
What is the molecular weight of (2-Phenylcyclohexyl) benzoate?
The molecular weight of (2-Phenylcyclohexyl) benzoate is 280.15 g/mol.
Where can I buy (2-Phenylcyclohexyl) benzoate?
You can request a quote for (2-Phenylcyclohexyl) benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Phenylcyclohexyl) benzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Phenylcyclohexyl) benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.