2,4,6-Trimethoxybenzaldehyde
TL;DR: 2,4,6-Trimethoxybenzaldehyde (CAS 830-79-5) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trimethoxybenzaldehyde
Also Known As: 2,4,6-Trimethoxybenzaldehyde, Benzaldehyde, 2,4,6-trimethoxy-, Trimetazidine impurity 34, Trimetazidine Impurity 24, CRBZVDLXAIFERF-UHFFFAOYSA-
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 830-79-5 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)OC)C=O)OC |
| InChIKey | CRBZVDLXAIFERF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Trimethoxybenzaldehyde (CAS 830-79-5), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: 2,4,6-trimethoxybenzaldehyde.
Chemical Property Profile of 2,4,6-Trimethoxybenzaldehyde
Property Insights of 2,4,6-Trimethoxybenzaldehyde
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Trimethoxybenzaldehyde. With a topological polar surface area (TPSA) of 44.8 Ų, 2,4,6-Trimethoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Trimethoxybenzaldehyde 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-Trimethoxybenzaldehyde?
The CAS number of 2,4,6-Trimethoxybenzaldehyde is 830-79-5.
What is the molecular formula of 2,4,6-Trimethoxybenzaldehyde?
The molecular formula of 2,4,6-Trimethoxybenzaldehyde is C10H12O4.
What is the molecular weight of 2,4,6-Trimethoxybenzaldehyde?
The molecular weight of 2,4,6-Trimethoxybenzaldehyde is 196.07 g/mol.
Where can I buy 2,4,6-Trimethoxybenzaldehyde?
You can request a quote for 2,4,6-Trimethoxybenzaldehyde 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-Trimethoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trimethoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.