Anisyl propionate
TL;DR: Anisyl propionate (CAS 7549-33-9) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl propanoate
Also Known As: ANISYL PROPIONATE, p-Methoxybenzyl propionate, (4-methoxyphenyl)methyl propanoate, para-anisyl propionate, 4-Methoxybenzyl propanoate
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 171.0 |
| Boiling Point | 277.00 °C. @ 760.00 mm Hg |
| Density | 1.070-1.086 |
| Solubility | insoluble in water, glycerol, propylene glycol; soluble in organic solvents, oils |
| Refractive Index | 1.505-1.510 |
Chemical Identifiers
| CAS Number | 7549-33-9 |
|---|---|
| SMILES | CCC(=O)OCC1=CC=C(C=C1)OC |
| InChIKey | YWIJRJQYADFRTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Anisyl propionate (CAS 7549-33-9), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: (4-methoxyphenyl)methyl propanoate.
Chemical Property Profile of Anisyl propionate
Property Insights of Anisyl propionate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anisyl propionate. With a topological polar surface area (TPSA) of 35.5 Ų, Anisyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anisyl propionate has 0 hydrogen bond donor(s) and 3 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 Anisyl propionate?
The CAS number of Anisyl propionate is 7549-33-9.
What is the molecular formula of Anisyl propionate?
The molecular formula of Anisyl propionate is C11H14O3.
What is the molecular weight of Anisyl propionate?
The molecular weight of Anisyl propionate is 194.09 g/mol.
Where can I buy Anisyl propionate?
You can request a quote for Anisyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anisyl propionate?
Yes, KEHONG BIO provides custom synthesis services for Anisyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.