2,2',2''-Methanetriyltris(4-tert-butylphenol)
TL;DR: 2,2',2''-Methanetriyltris(4-tert-butylphenol) (CAS 41567-36-6) is a chemical compound with molecular formula C31H40O3 and molecular weight 460.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(5-tert-butyl-2-hydroxyphenyl)methyl]-4-tert-butylphenol
Also Known As: 2,2',2''-methanetriyltris(4-tert-butylphenol), J1.617.208A, 2,2,2-methanetriyltris(4-tert-butylphenol), 11, 2,2 ,2 -Methanetriyltris(4-tert-butylphenol), 2-[bis(5-tert-butyl-2-hydroxyphenyl)methyl]-4-tert-butylphenol
| Molecular Formula | C31H40O3 |
|---|---|
| Molecular Weight | 460.30 g/mol |
| LogP | 9.2 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.29776 |
| Heavy Atoms | 34 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 41567-36-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)C(C2=C(C=CC(=C2)C(C)(C)C)O)C3=C(C=CC(=C3)C(C)(C)C)O |
| InChIKey | KBFBUZUSAWMXSM-UHFFFAOYSA-N |
Product Overview
2,2',2''-Methanetriyltris(4-tert-butylphenol) (CAS 41567-36-6), with molecular formula C31H40O3 and molecular weight 460.30 g/mol. IUPAC: 2-[bis(5-tert-butyl-2-hydroxyphenyl)methyl]-4-tert-butylphenol.
Chemical Property Profile of 2,2',2''-Methanetriyltris(4-tert-butylphenol)
Property Insights of 2,2',2''-Methanetriyltris(4-tert-butylphenol)
The XLogP value of 9.2 indicates that 2,2',2''-Methanetriyltris(4-tert-butylphenol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2',2''-Methanetriyltris(4-tert-butylphenol). Following Lipinski's Rule of Five, 2,2',2''-Methanetriyltris(4-tert-butylphenol) has 3 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 2,2',2''-Methanetriyltris(4-tert-butylphenol)?
The CAS number of 2,2',2''-Methanetriyltris(4-tert-butylphenol) is 41567-36-6.
What is the molecular formula of 2,2',2''-Methanetriyltris(4-tert-butylphenol)?
The molecular formula of 2,2',2''-Methanetriyltris(4-tert-butylphenol) is C31H40O3.
What is the molecular weight of 2,2',2''-Methanetriyltris(4-tert-butylphenol)?
The molecular weight of 2,2',2''-Methanetriyltris(4-tert-butylphenol) is 460.30 g/mol.
Where can I buy 2,2',2''-Methanetriyltris(4-tert-butylphenol)?
You can request a quote for 2,2',2''-Methanetriyltris(4-tert-butylphenol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2',2''-Methanetriyltris(4-tert-butylphenol)?
Yes, KEHONG BIO provides custom synthesis services for 2,2',2''-Methanetriyltris(4-tert-butylphenol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.