4-Propylbenzaldehyde diethyl acetal
TL;DR: 4-Propylbenzaldehyde diethyl acetal (CAS 89557-35-7) is a chemical compound with molecular formula C14H22O2 and molecular weight 222.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diethoxymethyl)-4-propylbenzene
Also Known As: 4-Propylbenzaldehyde diethyl acetal, 1-(Diethoxymethyl)-4-propylbenzene, Aluminium-dimethylbromid, 4-(Diethoxymethyl)propylbenzene, diethoxy(4-propylphenyl)methane
| Molecular Formula | C14H22O2 |
|---|---|
| Molecular Weight | 222.16 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 222.16199 |
| Heavy Atoms | 16 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 89557-35-7 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)C(OCC)OCC |
| InChIKey | FMARRBDLJSOXHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Propylbenzaldehyde diethyl acetal (CAS 89557-35-7), with molecular formula C14H22O2 and molecular weight 222.16 g/mol. IUPAC: 1-(diethoxymethyl)-4-propylbenzene.
Chemical Property Profile of 4-Propylbenzaldehyde diethyl acetal
Property Insights of 4-Propylbenzaldehyde diethyl acetal
The XLogP value of 3.6 indicates that 4-Propylbenzaldehyde diethyl acetal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 4-Propylbenzaldehyde diethyl acetal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Propylbenzaldehyde diethyl acetal 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 4-Propylbenzaldehyde diethyl acetal?
The CAS number of 4-Propylbenzaldehyde diethyl acetal is 89557-35-7.
What is the molecular formula of 4-Propylbenzaldehyde diethyl acetal?
The molecular formula of 4-Propylbenzaldehyde diethyl acetal is C14H22O2.
What is the molecular weight of 4-Propylbenzaldehyde diethyl acetal?
The molecular weight of 4-Propylbenzaldehyde diethyl acetal is 222.16 g/mol.
Where can I buy 4-Propylbenzaldehyde diethyl acetal?
You can request a quote for 4-Propylbenzaldehyde diethyl acetal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Propylbenzaldehyde diethyl acetal?
Yes, KEHONG BIO provides custom synthesis services for 4-Propylbenzaldehyde diethyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.