4-(Benzyloxy)phenyl hexanoate
TL;DR: 4-(Benzyloxy)phenyl hexanoate (CAS 105669-53-2) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-phenylmethoxyphenyl) hexanoate
Also Known As: Hexanoate, 4-(benzyloxy)phenyl hexanoate, (4-phenylmethoxyphenyl)hexanoate, (4-phenylmethoxyphenyl) hexanoate, Hexanoic acid 4-benzyloxy-phenyl ester
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 105669-53-2 |
|---|---|
| SMILES | CCCCCC(=O)OC1=CC=C(C=C1)OCC2=CC=CC=C2 |
| InChIKey | ZMUXNWZXGRAFMD-UHFFFAOYSA-N |
Product Overview
4-(Benzyloxy)phenyl hexanoate (CAS 105669-53-2), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: (4-phenylmethoxyphenyl) hexanoate.
Chemical Property Profile of 4-(Benzyloxy)phenyl hexanoate
Property Insights of 4-(Benzyloxy)phenyl hexanoate
The XLogP value of 5.0 indicates that 4-(Benzyloxy)phenyl hexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 4-(Benzyloxy)phenyl hexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Benzyloxy)phenyl hexanoate 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-(Benzyloxy)phenyl hexanoate?
The CAS number of 4-(Benzyloxy)phenyl hexanoate is 105669-53-2.
What is the molecular formula of 4-(Benzyloxy)phenyl hexanoate?
The molecular formula of 4-(Benzyloxy)phenyl hexanoate is C19H22O3.
What is the molecular weight of 4-(Benzyloxy)phenyl hexanoate?
The molecular weight of 4-(Benzyloxy)phenyl hexanoate is 298.16 g/mol.
Where can I buy 4-(Benzyloxy)phenyl hexanoate?
You can request a quote for 4-(Benzyloxy)phenyl hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Benzyloxy)phenyl hexanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Benzyloxy)phenyl hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.