(2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate
TL;DR: (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate (CAS 352641-72-6) is a chemical compound with molecular formula C21H36O4 and molecular weight 352.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,4,6-trimethyl-1-(pentanoyloxymethyl)cyclohex-3-en-1-yl]methyl pentanoate
Also Known As: (2,4,6-trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate, (2,4,6-trimethylcyclohex-3-ene-1,1-diyl)bis(methylene) dipentanoate, [2,4,6-trimethyl-1-(pentanoyloxymethyl)cyclohex-3-en-1-yl]methyl pentanoate
| Molecular Formula | C21H36O4 |
|---|---|
| Molecular Weight | 352.26 g/mol |
| LogP | 5.0618 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 352.26135 |
| Heavy Atoms | 25 |
| Complexity | 442.5165 |
Chemical Identifiers
| CAS Number | 352641-72-6 |
|---|---|
| SMILES | CCCCC(=O)OCC1(C(CC(=CC1C)C)C)COC(=O)CCCC |
Product Overview
(2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate (CAS 352641-72-6), with molecular formula C21H36O4 and molecular weight 352.26 g/mol. IUPAC: [2,4,6-trimethyl-1-(pentanoyloxymethyl)cyclohex-3-en-1-yl]methyl pentanoate.
Chemical Property Profile of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate
Property Insights of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate
The XLogP value of 5.0618 indicates that (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate?
The CAS number of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate is 352641-72-6.
What is the molecular formula of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate?
The molecular formula of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate is C21H36O4.
What is the molecular weight of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate?
The molecular weight of (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate is 352.26 g/mol.
Where can I buy (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate?
You can request a quote for (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate?
Yes, KEHONG BIO provides custom synthesis services for (2,4,6-Trimethylcyclohex-3-ene-1,1-diyl)dimethanediyl dipentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.