1,2,4-Triethoxybenzene
TL;DR: 1,2,4-Triethoxybenzene (CAS 41827-15-0) is a chemical compound with molecular formula C12H18O3 and molecular weight 210.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4-triethoxybenzene
Also Known As: 1,2,4-triethoxybenzene, Pirenoxine Impurity 1, 1,2,4-triethoxy-benzene, Oxyhydrochinontriaethylaether, benzene, 1,3,4-triethoxy-
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 41827-15-0 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)OCC)OCC |
| InChIKey | MTXHYYFYFLXUEN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,4-Triethoxybenzene (CAS 41827-15-0), with molecular formula C12H18O3 and molecular weight 210.13 g/mol. IUPAC: 1,2,4-triethoxybenzene.
Chemical Property Profile of 1,2,4-Triethoxybenzene
Property Insights of 1,2,4-Triethoxybenzene
The XLogP value of 3.2 indicates that 1,2,4-Triethoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 1,2,4-Triethoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Triethoxybenzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2,4-Triethoxybenzene?
The CAS number of 1,2,4-Triethoxybenzene is 41827-15-0.
What is the molecular formula of 1,2,4-Triethoxybenzene?
The molecular formula of 1,2,4-Triethoxybenzene is C12H18O3.
What is the molecular weight of 1,2,4-Triethoxybenzene?
The molecular weight of 1,2,4-Triethoxybenzene is 210.13 g/mol.
Where can I buy 1,2,4-Triethoxybenzene?
You can request a quote for 1,2,4-Triethoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Triethoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Triethoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.