Dipropoxymethylbenzene
TL;DR: Dipropoxymethylbenzene (CAS 1588-05-2) is a chemical compound with molecular formula C13H20O2 and molecular weight 208.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropoxymethylbenzene
Also Known As: dipropoxymethylbenzene, (dipropoxymethyl)benzene, Benzaldehyde dipropyl acetal, RefChem:339066
| Molecular Formula | C13H20O2 |
|---|---|
| Molecular Weight | 208.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 208.14633 |
| Heavy Atoms | 15 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 1588-05-2 |
|---|---|
| SMILES | CCCOC(C1=CC=CC=C1)OCCC |
| InChIKey | XMWNZIXDZWUYTK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dipropoxymethylbenzene (CAS 1588-05-2), with molecular formula C13H20O2 and molecular weight 208.15 g/mol. IUPAC: dipropoxymethylbenzene.
Chemical Property Profile of Dipropoxymethylbenzene
Property Insights of Dipropoxymethylbenzene
The XLogP value of 3.3 indicates that Dipropoxymethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Dipropoxymethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dipropoxymethylbenzene 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 Dipropoxymethylbenzene?
The CAS number of Dipropoxymethylbenzene is 1588-05-2.
What is the molecular formula of Dipropoxymethylbenzene?
The molecular formula of Dipropoxymethylbenzene is C13H20O2.
What is the molecular weight of Dipropoxymethylbenzene?
The molecular weight of Dipropoxymethylbenzene is 208.15 g/mol.
Where can I buy Dipropoxymethylbenzene?
You can request a quote for Dipropoxymethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropoxymethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Dipropoxymethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.