2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone
TL;DR: 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone (CAS 52186-13-7) is a chemical compound with molecular formula C25H32O4 and molecular weight 396.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methoxy-(4-methoxyphenyl)methyl]-8-[(4-methoxyphenyl)methyl]cyclooctan-1-one
Also Known As: 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone, 2-(Methoxy(4-methoxyphenyl)methyl)-8-((4-methoxyphenyl)methyl)cyclooctanone, 2-[Methoxy(4-methoxyphenyl)methyl]-8-[(4-methoxyphenyl)methyl]cyclooctan-1-one, 2-[methoxy-(4-methoxyphenyl)methyl]-8-[(4-methoxyphenyl)methyl]cyclooctan-1-one, Cyclooctanone, 2-(methoxy(4-methoxyphenyl)methyl)-8-((4-methoxyphenyl)methyl)-
| Molecular Formula | C25H32O4 |
|---|---|
| Molecular Weight | 396.23 g/mol |
| LogP | 5.3996 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.23007 |
| Heavy Atoms | 29 |
| Complexity | 766.4153 |
Chemical Identifiers
| CAS Number | 52186-13-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2CCCCCC(C2=O)C(C3=CC=C(C=C3)OC)OC |
Product Overview
2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone (CAS 52186-13-7), with molecular formula C25H32O4 and molecular weight 396.23 g/mol. IUPAC: 2-[methoxy-(4-methoxyphenyl)methyl]-8-[(4-methoxyphenyl)methyl]cyclooctan-1-one.
Chemical Property Profile of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone
Property Insights of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone
The XLogP value of 5.3996 indicates that 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone 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 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone?
The CAS number of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone is 52186-13-7.
What is the molecular formula of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone?
The molecular formula of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone is C25H32O4.
What is the molecular weight of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone?
The molecular weight of 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone is 396.23 g/mol.
Where can I buy 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone?
You can request a quote for 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone?
Yes, KEHONG BIO provides custom synthesis services for 2,8-Bis(2,4,6-trimethylbenzyl)cyclooctanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.