3,4,5-Trimethoxybenzaldehyde dimethyl acetal
TL;DR: 3,4,5-Trimethoxybenzaldehyde dimethyl acetal (CAS 59276-37-8) is a chemical compound with molecular formula C12H18O5 and molecular weight 242.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethoxymethyl)-1,2,3-trimethoxybenzene
Also Known As: 3,4,5-Trimethoxybenzaldehyde dimethyl acetal, 5-(dimethoxymethyl)-1,2,3-trimethoxybenzene, 1,2,3-Trimethoxy-5-(dimethoxymethyl)benzene, 3,4,5-trimethoxy-benzaldehyde dimethyl acetal, 5-(dimethoxymethyl)-1,2,3-trimethoxy-benzene
| Molecular Formula | C12H18O5 |
|---|---|
| Molecular Weight | 242.12 g/mol |
| LogP | 2.0038 |
| Topological Polar Surface Area | 46.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 242.11542 |
| Heavy Atoms | 17 |
| Complexity | 334.90878 |
Chemical Identifiers
| CAS Number | 59276-37-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(OC)OC |
Product Overview
3,4,5-Trimethoxybenzaldehyde dimethyl acetal (CAS 59276-37-8), with molecular formula C12H18O5 and molecular weight 242.12 g/mol. IUPAC: 5-(dimethoxymethyl)-1,2,3-trimethoxybenzene.
Chemical Property Profile of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal
Property Insights of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal
The XLogP value of 2.0038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-Trimethoxybenzaldehyde dimethyl acetal. With a topological polar surface area (TPSA) of 46.15 Ų, 3,4,5-Trimethoxybenzaldehyde dimethyl acetal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Trimethoxybenzaldehyde dimethyl acetal has 0 hydrogen bond donor(s) and 5 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 3,4,5-Trimethoxybenzaldehyde dimethyl acetal?
The CAS number of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal is 59276-37-8.
What is the molecular formula of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal?
The molecular formula of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal is C12H18O5.
What is the molecular weight of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal?
The molecular weight of 3,4,5-Trimethoxybenzaldehyde dimethyl acetal is 242.12 g/mol.
Where can I buy 3,4,5-Trimethoxybenzaldehyde dimethyl acetal?
You can request a quote for 3,4,5-Trimethoxybenzaldehyde dimethyl acetal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-Trimethoxybenzaldehyde dimethyl acetal?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-Trimethoxybenzaldehyde dimethyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.