(2,2-Dimethoxycyclohexyl) benzoate
TL;DR: (2,2-Dimethoxycyclohexyl) benzoate (CAS 7472-22-2) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethoxycyclohexyl) benzoate
Also Known As: (2,2-dimethoxycyclohexyl) benzoate, 2,2-DIMETHOXYCYCLOHEXYL BENZOATE
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 7472-22-2 |
|---|---|
| SMILES | COC1(CCCCC1OC(=O)C2=CC=CC=C2)OC |
| InChIKey | QCHZLWFHCGPREO-UHFFFAOYSA-N |
Product Overview
(2,2-Dimethoxycyclohexyl) benzoate (CAS 7472-22-2), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: (2,2-dimethoxycyclohexyl) benzoate.
Chemical Property Profile of (2,2-Dimethoxycyclohexyl) benzoate
Property Insights of (2,2-Dimethoxycyclohexyl) benzoate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,2-Dimethoxycyclohexyl) benzoate. With a topological polar surface area (TPSA) of 44.8 Ų, (2,2-Dimethoxycyclohexyl) benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,2-Dimethoxycyclohexyl) benzoate has 0 hydrogen bond donor(s) and 4 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 (2,2-Dimethoxycyclohexyl) benzoate?
The CAS number of (2,2-Dimethoxycyclohexyl) benzoate is 7472-22-2.
What is the molecular formula of (2,2-Dimethoxycyclohexyl) benzoate?
The molecular formula of (2,2-Dimethoxycyclohexyl) benzoate is C15H20O4.
What is the molecular weight of (2,2-Dimethoxycyclohexyl) benzoate?
The molecular weight of (2,2-Dimethoxycyclohexyl) benzoate is 264.14 g/mol.
Where can I buy (2,2-Dimethoxycyclohexyl) benzoate?
You can request a quote for (2,2-Dimethoxycyclohexyl) benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,2-Dimethoxycyclohexyl) benzoate?
Yes, KEHONG BIO provides custom synthesis services for (2,2-Dimethoxycyclohexyl) benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.