4-丙基苯甲醚
TL;DR: 4-丙基苯甲醚 (CAS 104-45-0) is a chemical compound with molecular formula C10H14O and molecular weight 150.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-丙基苯甲醚
1-methoxy-4-propylbenzene
Also Known As: 4-Propylanisole, 1-Methoxy-4-propylbenzene, Dihydroanethole, p-Propylanisole, p-Propyl anisole
| Molecular Formula | C10H14O |
|---|---|
| Molecular Weight | 150.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.10446 |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
| Boiling Point | 212.00 to 213.00 °C. @ 760.00 mm Hg |
| Density | 0.940-0.943 |
| Solubility | Slightly soluble in water, Miscible in oils |
| Refractive Index | 1.503-1.506 |
Chemical Identifiers
| CAS Number | 104-45-0 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)OC |
| InChIKey | KBHWKXNXTURZCD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-丙基苯甲醚 (CAS 104-45-0), with molecular formula C10H14O and molecular weight 150.10 g/mol. IUPAC: 1-methoxy-4-propylbenzene.
Chemical Property Profile of 4-丙基苯甲醚
Property Insights of 4-丙基苯甲醚
The XLogP value of 3.5 indicates that 4-丙基苯甲醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 4-丙基苯甲醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-丙基苯甲醚 has 0 hydrogen bond donor(s) and 1 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-丙基苯甲醚?
The CAS number of 4-丙基苯甲醚 is 104-45-0.
What is the molecular formula of 4-丙基苯甲醚?
The molecular formula of 4-丙基苯甲醚 is C10H14O.
What is the molecular weight of 4-丙基苯甲醚?
The molecular weight of 4-丙基苯甲醚 is 150.10 g/mol.
Where can I buy 4-丙基苯甲醚?
You can request a quote for 4-丙基苯甲醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-丙基苯甲醚?
Yes, KEHONG BIO provides custom synthesis services for 4-丙基苯甲醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.