2,4,6-三乙氧基苯甲醛
TL;DR: 2,4,6-三乙氧基苯甲醛 (CAS 59652-88-9) is a chemical compound with molecular formula C13H18O4 and molecular weight 238.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-三乙氧基苯甲醛
2,4,6-triethoxybenzaldehyde
Also Known As: 2,4,6-triethoxybenzaldehyde, Thiothiamine, Benzaldehyde,2,4,6-triethoxy-, 2,4,6-triethoxybenzaldehyd, 2,4,6-triethoxy-benzaldehyde
| Molecular Formula | C13H18O4 |
|---|---|
| Molecular Weight | 238.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 238.12051 |
| Heavy Atoms | 17 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 59652-88-9 |
|---|---|
| SMILES | CCOC1=CC(=C(C(=C1)OCC)C=O)OCC |
| InChIKey | FXNZCYUMRHJSFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-三乙氧基苯甲醛 (CAS 59652-88-9), with molecular formula C13H18O4 and molecular weight 238.12 g/mol. IUPAC: 2,4,6-triethoxybenzaldehyde.
Chemical Property Profile of 2,4,6-三乙氧基苯甲醛
Property Insights of 2,4,6-三乙氧基苯甲醛
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-三乙氧基苯甲醛. With a topological polar surface area (TPSA) of 44.8 Ų, 2,4,6-三乙氧基苯甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-三乙氧基苯甲醛 has 0 hydrogen bond donor(s) and 4 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 2,4,6-三乙氧基苯甲醛?
The CAS number of 2,4,6-三乙氧基苯甲醛 is 59652-88-9.
What is the molecular formula of 2,4,6-三乙氧基苯甲醛?
The molecular formula of 2,4,6-三乙氧基苯甲醛 is C13H18O4.
What is the molecular weight of 2,4,6-三乙氧基苯甲醛?
The molecular weight of 2,4,6-三乙氧基苯甲醛 is 238.12 g/mol.
Where can I buy 2,4,6-三乙氧基苯甲醛?
You can request a quote for 2,4,6-三乙氧基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-三乙氧基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-三乙氧基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.