Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)
TL;DR: Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) (CAS 35074-77-2) is a chemical compound with molecular formula C40H62O6 and molecular weight 638.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]hexyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
Also Known As: Irganox 259, Irganox 249, Irganox L-109, ANTIOXIDANT 259, Hexamethylene bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate]
| Molecular Formula | C40H62O6 |
|---|---|
| Molecular Weight | 638.45 g/mol |
| LogP | 11.2 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 19 |
| Exact Mass | 638.45465 |
| Heavy Atoms | 46 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 35074-77-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCCCCCCOC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C |
| InChIKey | ZVVFVKJZNVSANF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) (CAS 35074-77-2), with molecular formula C40H62O6 and molecular weight 638.45 g/mol. IUPAC: 6-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]hexyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate.
Chemical Property Profile of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)
Property Insights of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)
The XLogP value of 11.2 indicates that Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate). Following Lipinski's Rule of Five, Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)?
The CAS number of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) is 35074-77-2.
What is the molecular formula of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)?
The molecular formula of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) is C40H62O6.
What is the molecular weight of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)?
The molecular weight of Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) is 638.45 g/mol.
Where can I buy Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)?
You can request a quote for Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)?
Yes, KEHONG BIO provides custom synthesis services for Hexamethylene glycol bis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.