Pentyl decyl phthalate
TL;DR: Pentyl decyl phthalate (CAS 7493-81-4) is a chemical compound with molecular formula C23H36O4 and molecular weight 376.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-decyl 1-O-pentyl benzene-1,2-dicarboxylate
Also Known As: Pentyl decyl phthalate, N-AMYL N-Decyl phthalate, AMYL DECYL PHTHALATE, Phthalic acid, decyl pentyl ester, Phthalic acid, decylpentyl ester
| Molecular Formula | C23H36O4 |
|---|---|
| Molecular Weight | 376.26 g/mol |
| LogP | 6.3311 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 376.26135 |
| Heavy Atoms | 27 |
| Complexity | 538.9348 |
Chemical Identifiers
| CAS Number | 7493-81-4 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC |
Product Overview
Pentyl decyl phthalate (CAS 7493-81-4), with molecular formula C23H36O4 and molecular weight 376.26 g/mol. IUPAC: 2-O-decyl 1-O-pentyl benzene-1,2-dicarboxylate.
Chemical Property Profile of Pentyl decyl phthalate
Property Insights of Pentyl decyl phthalate
The XLogP value of 6.3311 indicates that Pentyl decyl phthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Pentyl decyl phthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentyl decyl phthalate 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 Pentyl decyl phthalate?
The CAS number of Pentyl decyl phthalate is 7493-81-4.
What is the molecular formula of Pentyl decyl phthalate?
The molecular formula of Pentyl decyl phthalate is C23H36O4.
What is the molecular weight of Pentyl decyl phthalate?
The molecular weight of Pentyl decyl phthalate is 376.26 g/mol.
Where can I buy Pentyl decyl phthalate?
You can request a quote for Pentyl decyl phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentyl decyl phthalate?
Yes, KEHONG BIO provides custom synthesis services for Pentyl decyl phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.