2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione
TL;DR: 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione (CAS 172292-86-3) is a chemical compound with molecular formula C23H34O3 and molecular weight 358.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
Also Known As: 2-(3,5-di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione, 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione, 2-[(4-hydroxy-3,5-ditert-butyl-phenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione
| Molecular Formula | C23H34O3 |
|---|---|
| Molecular Weight | 358.25 g/mol |
| LogP | 5.1041 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.2508 |
| Heavy Atoms | 26 |
| Complexity | 671.7954 |
Chemical Identifiers
| CAS Number | 172292-86-3 |
|---|---|
| SMILES | CC1(CC(=O)C(C(=O)C1)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C |
Product Overview
2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione (CAS 172292-86-3), with molecular formula C23H34O3 and molecular weight 358.25 g/mol. IUPAC: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione.
Chemical Property Profile of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione
Property Insights of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione
The XLogP value of 5.1041 indicates that 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione?
The CAS number of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione is 172292-86-3.
What is the molecular formula of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione?
The molecular formula of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione is C23H34O3.
What is the molecular weight of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione?
The molecular weight of 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione is 358.25 g/mol.
Where can I buy 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione?
You can request a quote for 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-Di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.