2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)
TL;DR: 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) (CAS 40255-63-8) is a chemical compound with molecular formula C29H44O4 and molecular weight 456.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-ditert-butyl-2-[(3,5-ditert-butyl-2,6-dihydroxyphenyl)methyl]benzene-1,3-diol
Also Known As: 2,2'-Methylenebis(4,6-di-tert-butylresorcinol), 2,2'-methylenebis(4,6-di-tert-butylbenzene-1,3-diol), 2,2'-methanediylbis(4,6-di-tert-butylbenzene-1,3-diol), 1,3-Benzenediol, 2,2'-methylenebis(4,6-bis(1,1-dimethylethyl)-, 2,2'-Methylenebis(4,6-bis(1,1-dimethylethyl)-1,3-benzenediol)
| Molecular Formula | C29H44O4 |
|---|---|
| Molecular Weight | 456.32 g/mol |
| LogP | 9.1 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.32397 |
| Heavy Atoms | 33 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 40255-63-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C(=C1O)CC2=C(C(=CC(=C2O)C(C)(C)C)C(C)(C)C)O)O)C(C)(C)C |
| InChIKey | BDENIXXGMSURKB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) (CAS 40255-63-8), with molecular formula C29H44O4 and molecular weight 456.32 g/mol. IUPAC: 4,6-ditert-butyl-2-[(3,5-ditert-butyl-2,6-dihydroxyphenyl)methyl]benzene-1,3-diol.
Chemical Property Profile of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)
Property Insights of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)
The XLogP value of 9.1 indicates that 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol). Following Lipinski's Rule of Five, 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) has 4 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 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)?
The CAS number of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) is 40255-63-8.
What is the molecular formula of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)?
The molecular formula of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) is C29H44O4.
What is the molecular weight of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)?
The molecular weight of 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) is 456.32 g/mol.
Where can I buy 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)?
You can request a quote for 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Methylenebis(4,6-di-tert-butylbenzene-1,3-diol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.