Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-
TL;DR: Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- (CAS 96501-85-8) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-2-propan-2-yloxybenzaldehyde
Also Known As: Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-, 4,5-dimethoxy-2-propan-2-yloxybenzaldehyde, 4,5-Dimethoxy-2-[(propan-2-yl)oxy]benzaldehyde, 4,5-dimethoxy-2-isopropoxybenzene-1-carboaldehyde
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 96501-85-8 |
|---|---|
| SMILES | CC(C)OC1=CC(=C(C=C1C=O)OC)OC |
| InChIKey | QPOPBYLRYTYFPH-UHFFFAOYSA-N |
Product Overview
Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- (CAS 96501-85-8), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: 4,5-dimethoxy-2-propan-2-yloxybenzaldehyde.
Chemical Property Profile of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-
Property Insights of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-. With a topological polar surface area (TPSA) of 44.8 Ų, Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- 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 Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-?
The CAS number of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- is 96501-85-8.
What is the molecular formula of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-?
The molecular formula of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- is C12H16O4.
What is the molecular weight of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-?
The molecular weight of Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- is 224.10 g/mol.
Where can I buy Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-?
You can request a quote for Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 4,5-dimethoxy-2-(1-methylethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.