2-Methyl-3-(p-methoxyphenyl)propanal
TL;DR: 2-Methyl-3-(p-methoxyphenyl)propanal (CAS 5462-06-6) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-2-methylpropanal
Also Known As: 3-(4-methoxyphenyl)-2-methylpropanal, Canthoxal, 2-Anisylpropional, 2-(p-Anisyl)propanal, p-Methoxyhydratropaldehyde
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 5462-06-6 |
|---|---|
| SMILES | CC(CC1=CC=C(C=C1)OC)C=O |
| InChIKey | VLFBSPUPYFTTNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-3-(p-methoxyphenyl)propanal (CAS 5462-06-6), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 3-(4-methoxyphenyl)-2-methylpropanal.
Chemical Property Profile of 2-Methyl-3-(p-methoxyphenyl)propanal
Property Insights of 2-Methyl-3-(p-methoxyphenyl)propanal
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-(p-methoxyphenyl)propanal. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methyl-3-(p-methoxyphenyl)propanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-(p-methoxyphenyl)propanal has 0 hydrogen bond donor(s) and 2 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-Methyl-3-(p-methoxyphenyl)propanal?
The CAS number of 2-Methyl-3-(p-methoxyphenyl)propanal is 5462-06-6.
What is the molecular formula of 2-Methyl-3-(p-methoxyphenyl)propanal?
The molecular formula of 2-Methyl-3-(p-methoxyphenyl)propanal is C11H14O2.
What is the molecular weight of 2-Methyl-3-(p-methoxyphenyl)propanal?
The molecular weight of 2-Methyl-3-(p-methoxyphenyl)propanal is 178.10 g/mol.
Where can I buy 2-Methyl-3-(p-methoxyphenyl)propanal?
You can request a quote for 2-Methyl-3-(p-methoxyphenyl)propanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-(p-methoxyphenyl)propanal?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-(p-methoxyphenyl)propanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.