乙醛苯乙基丙基缩醛
TL;DR: 乙醛苯乙基丙基缩醛 (CAS 7493-57-4) 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.
乙醛苯乙基丙基缩醛
2-(1-propoxyethoxy)ethylbenzene
Also Known As: Acetal R, Pepital, (2-(1-Propoxyethoxy)ethyl)benzene, resedafol, Propyl phenethyl acetal
| 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 | 141.0 |
| Boiling Point | 79.00 to 81.00 °C. @ 0.75 mm Hg |
| Density | 0.944-0.950 |
| Solubility | 201 mg/L @ 20 °C (exp) |
| Refractive Index | 1.475-1.483 |
Chemical Identifiers
| CAS Number | 7493-57-4 |
|---|---|
| SMILES | CCCOC(C)OCCC1=CC=CC=C1 |
| InChIKey | FMYCPRQGKSONCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙醛苯乙基丙基缩醛 (CAS 7493-57-4), with molecular formula C13H20O2 and molecular weight 208.15 g/mol. IUPAC: 2-(1-propoxyethoxy)ethylbenzene.
Chemical Property Profile of 乙醛苯乙基丙基缩醛
Property Insights of 乙醛苯乙基丙基缩醛
The XLogP value of 3.3 indicates that 乙醛苯乙基丙基缩醛 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 乙醛苯乙基丙基缩醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙醛苯乙基丙基缩醛 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 乙醛苯乙基丙基缩醛?
The CAS number of 乙醛苯乙基丙基缩醛 is 7493-57-4.
What is the molecular formula of 乙醛苯乙基丙基缩醛?
The molecular formula of 乙醛苯乙基丙基缩醛 is C13H20O2.
What is the molecular weight of 乙醛苯乙基丙基缩醛?
The molecular weight of 乙醛苯乙基丙基缩醛 is 208.15 g/mol.
Where can I buy 乙醛苯乙基丙基缩醛?
You can request a quote for 乙醛苯乙基丙基缩醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙醛苯乙基丙基缩醛?
Yes, KEHONG BIO provides custom synthesis services for 乙醛苯乙基丙基缩醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.