![2-Methyl-4,6-bis[(octylthio)methyl]phenol structure](/static/products/1105/110553-27-0.webp)
2-Methyl-4,6-bis[(octylthio)methyl]phenol
TL;DR: 2-Methyl-4,6-bis[(octylthio)methyl]phenol (CAS 110553-27-0) is a chemical compound with molecular formula C25H44OS2 and molecular weight 424.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4,6-bis(octylsulfanylmethyl)phenol
Also Known As: Irganox 1520, 2-methyl-4,6-bis(octylsulfanylmethyl)phenol, 4,6-Bis(octylthiomethyl)-o-cresol, Antioxidant TH1520, 2-methyl-4,6-bis((octylthio)methyl)phenol
| Molecular Formula | C25H44OS2 |
|---|---|
| Molecular Weight | 424.28 g/mol |
| LogP | 9.7 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 424.28336 |
| Heavy Atoms | 28 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 110553-27-0 |
|---|---|
| SMILES | CCCCCCCCSCC1=CC(=C(C(=C1)C)O)CSCCCCCCCC |
| InChIKey | GAODDBNJCKQQDY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-4,6-bis[(octylthio)methyl]phenol (CAS 110553-27-0), with molecular formula C25H44OS2 and molecular weight 424.28 g/mol. IUPAC: 2-methyl-4,6-bis(octylsulfanylmethyl)phenol.
Chemical Property Profile of 2-Methyl-4,6-bis[(octylthio)methyl]phenol
Property Insights of 2-Methyl-4,6-bis[(octylthio)methyl]phenol
The XLogP value of 9.7 indicates that 2-Methyl-4,6-bis[(octylthio)methyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-4,6-bis[(octylthio)methyl]phenol. Following Lipinski's Rule of Five, 2-Methyl-4,6-bis[(octylthio)methyl]phenol 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-Methyl-4,6-bis[(octylthio)methyl]phenol?
The CAS number of 2-Methyl-4,6-bis[(octylthio)methyl]phenol is 110553-27-0.
What is the molecular formula of 2-Methyl-4,6-bis[(octylthio)methyl]phenol?
The molecular formula of 2-Methyl-4,6-bis[(octylthio)methyl]phenol is C25H44OS2.
What is the molecular weight of 2-Methyl-4,6-bis[(octylthio)methyl]phenol?
The molecular weight of 2-Methyl-4,6-bis[(octylthio)methyl]phenol is 424.28 g/mol.
Where can I buy 2-Methyl-4,6-bis[(octylthio)methyl]phenol?
You can request a quote for 2-Methyl-4,6-bis[(octylthio)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4,6-bis[(octylthio)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4,6-bis[(octylthio)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.