Benzoic acid, 3-methoxy-, nonyl ester
TL;DR: Benzoic acid, 3-methoxy-, nonyl ester (CAS 69833-39-2) is a chemical compound with molecular formula C17H26O3 and molecular weight 278.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonyl 3-methoxybenzoate
Also Known As: Nonyl 3-methoxybenzoate, m-Anisic acid, nonyl ester, 3-Methoxybenzoicacidnonylester, Nonyl 3-methoxybenzoate #, Benzoic acid, 3-methoxy-, nonyl ester
| Molecular Formula | C17H26O3 |
|---|---|
| Molecular Weight | 278.19 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 278.1882 |
| Heavy Atoms | 20 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 69833-39-2 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)C1=CC(=CC=C1)OC |
| InChIKey | JGZASOMUZAPRAP-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3-methoxy-, nonyl ester (CAS 69833-39-2), with molecular formula C17H26O3 and molecular weight 278.19 g/mol. IUPAC: nonyl 3-methoxybenzoate.
Chemical Property Profile of Benzoic acid, 3-methoxy-, nonyl ester
Property Insights of Benzoic acid, 3-methoxy-, nonyl ester
The XLogP value of 6.2 indicates that Benzoic acid, 3-methoxy-, nonyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Benzoic acid, 3-methoxy-, nonyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 3-methoxy-, nonyl ester 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 Benzoic acid, 3-methoxy-, nonyl ester?
The CAS number of Benzoic acid, 3-methoxy-, nonyl ester is 69833-39-2.
What is the molecular formula of Benzoic acid, 3-methoxy-, nonyl ester?
The molecular formula of Benzoic acid, 3-methoxy-, nonyl ester is C17H26O3.
What is the molecular weight of Benzoic acid, 3-methoxy-, nonyl ester?
The molecular weight of Benzoic acid, 3-methoxy-, nonyl ester is 278.19 g/mol.
Where can I buy Benzoic acid, 3-methoxy-, nonyl ester?
You can request a quote for Benzoic acid, 3-methoxy-, nonyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3-methoxy-, nonyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3-methoxy-, nonyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.