1ilh
TL;DR: 1ilh (CAS 126411-39-0) is a chemical compound with molecular formula C24H42O7P2 and molecular weight 504.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2,2-bis(diethoxyphosphoryl)ethenyl]-2,6-ditert-butylphenol
Also Known As: 1ilh, BIDD:PXR0009, 4-[2,2-bis(diethoxyphosphoryl)ethenyl]-2,6-ditert-butylphenol, s8302, SR 12813, >=98%, solid
| Molecular Formula | C24H42O7P2 |
|---|---|
| Molecular Weight | 504.24 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 504.24057 |
| Heavy Atoms | 33 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 126411-39-0 |
|---|---|
| SMILES | CCOP(=O)(C(=CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)P(=O)(OCC)OCC)OCC |
| InChIKey | YQLJDECYQDRSBI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1ilh (CAS 126411-39-0), with molecular formula C24H42O7P2 and molecular weight 504.24 g/mol. IUPAC: 4-[2,2-bis(diethoxyphosphoryl)ethenyl]-2,6-ditert-butylphenol.
Chemical Property Profile of 1ilh
Property Insights of 1ilh
The XLogP value of 5.2 indicates that 1ilh is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1ilh. Following Lipinski's Rule of Five, 1ilh has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1ilh?
The CAS number of 1ilh is 126411-39-0.
What is the molecular formula of 1ilh?
The molecular formula of 1ilh is C24H42O7P2.
What is the molecular weight of 1ilh?
The molecular weight of 1ilh is 504.24 g/mol.
Where can I buy 1ilh?
You can request a quote for 1ilh directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1ilh?
Yes, KEHONG BIO provides custom synthesis services for 1ilh and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.