Phthalic acid, nonyl pentyl ester
TL;DR: Phthalic acid, nonyl pentyl ester (CAS 26272-53-7) is a chemical compound with molecular formula C22H34O4 and molecular weight 362.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-nonyl 1-O-pentyl benzene-1,2-dicarboxylate
Also Known As: Nonyl pentyl phthalate, Phthalic acid, nonyl pentyl ester, Nonyl pentyl benzene-1,2-dicarboxylate, 2-O-nonyl 1-O-pentyl benzene-1,2-dicarboxylate
| Molecular Formula | C22H34O4 |
|---|---|
| Molecular Weight | 362.25 g/mol |
| LogP | 5.941 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 362.2457 |
| Heavy Atoms | 26 |
| Complexity | 524.6285 |
Chemical Identifiers
| CAS Number | 26272-53-7 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC |
Product Overview
Phthalic acid, nonyl pentyl ester (CAS 26272-53-7), with molecular formula C22H34O4 and molecular weight 362.25 g/mol. IUPAC: 2-O-nonyl 1-O-pentyl benzene-1,2-dicarboxylate.
Chemical Property Profile of Phthalic acid, nonyl pentyl ester
Property Insights of Phthalic acid, nonyl pentyl ester
The XLogP value of 5.941 indicates that Phthalic acid, nonyl pentyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Phthalic acid, nonyl pentyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phthalic acid, nonyl pentyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phthalic acid, nonyl pentyl ester?
The CAS number of Phthalic acid, nonyl pentyl ester is 26272-53-7.
What is the molecular formula of Phthalic acid, nonyl pentyl ester?
The molecular formula of Phthalic acid, nonyl pentyl ester is C22H34O4.
What is the molecular weight of Phthalic acid, nonyl pentyl ester?
The molecular weight of Phthalic acid, nonyl pentyl ester is 362.25 g/mol.
Where can I buy Phthalic acid, nonyl pentyl ester?
You can request a quote for Phthalic acid, nonyl pentyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phthalic acid, nonyl pentyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phthalic acid, nonyl pentyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.