(4-Methoxyphenyl)methyl heptanoate
TL;DR: (4-Methoxyphenyl)methyl heptanoate (CAS 71607-51-7) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl heptanoate
Also Known As: methylheptanoate, Anisyl heptanoate, (4-Methoxyphenyl)methyl heptanoate, EINECS 275-692-2, Heptanoic acid (4-methoxyphenyl)methyl ester
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 3.7088 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 343.26126 |
Chemical Identifiers
| CAS Number | 71607-51-7 |
|---|---|
| SMILES | CCCCCCC(=O)OCC1=CC=C(C=C1)OC |
Product Overview
(4-Methoxyphenyl)methyl heptanoate (CAS 71607-51-7), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: (4-methoxyphenyl)methyl heptanoate.
Chemical Property Profile of (4-Methoxyphenyl)methyl heptanoate
Property Insights of (4-Methoxyphenyl)methyl heptanoate
The XLogP value of 3.7088 indicates that (4-Methoxyphenyl)methyl heptanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, (4-Methoxyphenyl)methyl heptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methoxyphenyl)methyl heptanoate 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 (4-Methoxyphenyl)methyl heptanoate?
The CAS number of (4-Methoxyphenyl)methyl heptanoate is 71607-51-7.
What is the molecular formula of (4-Methoxyphenyl)methyl heptanoate?
The molecular formula of (4-Methoxyphenyl)methyl heptanoate is C15H22O3.
What is the molecular weight of (4-Methoxyphenyl)methyl heptanoate?
The molecular weight of (4-Methoxyphenyl)methyl heptanoate is 250.16 g/mol.
Where can I buy (4-Methoxyphenyl)methyl heptanoate?
You can request a quote for (4-Methoxyphenyl)methyl heptanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methoxyphenyl)methyl heptanoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Methoxyphenyl)methyl heptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.