Octyl 4-methoxybenzoate
TL;DR: Octyl 4-methoxybenzoate (CAS 75156-21-7) is a chemical compound with molecular formula C16H24O3 and molecular weight 264.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octyl 4-methoxybenzoate
Also Known As: Octyl 4-methoxybenzoate, Octyl 4-methoxybenzoate #, p-Methoxybenzoic acid, octyl ester, 4-Methoxybenzoic acid octyl ester, Benzoic acid,4-methoxy-, octyl ester
| Molecular Formula | C16H24O3 |
|---|---|
| Molecular Weight | 264.17 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 264.17255 |
| Heavy Atoms | 19 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 75156-21-7 |
|---|---|
| SMILES | CCCCCCCCOC(=O)C1=CC=C(C=C1)OC |
| InChIKey | MYWIXKRFXVEVBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octyl 4-methoxybenzoate (CAS 75156-21-7), with molecular formula C16H24O3 and molecular weight 264.17 g/mol. IUPAC: octyl 4-methoxybenzoate.
Chemical Property Profile of Octyl 4-methoxybenzoate
Property Insights of Octyl 4-methoxybenzoate
The XLogP value of 5.7 indicates that Octyl 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Octyl 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octyl 4-methoxybenzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octyl 4-methoxybenzoate?
The CAS number of Octyl 4-methoxybenzoate is 75156-21-7.
What is the molecular formula of Octyl 4-methoxybenzoate?
The molecular formula of Octyl 4-methoxybenzoate is C16H24O3.
What is the molecular weight of Octyl 4-methoxybenzoate?
The molecular weight of Octyl 4-methoxybenzoate is 264.17 g/mol.
Where can I buy Octyl 4-methoxybenzoate?
You can request a quote for Octyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Octyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.