Decyl 2-ethylhexyl phthalate
TL;DR: Decyl 2-ethylhexyl phthalate (CAS 85391-46-4) is a chemical compound with molecular formula C26H42O4 and molecular weight 418.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-decyl 2-O-(2-ethylhexyl) benzene-1,2-dicarboxylate
Also Known As: Decyl 2-ethylhexyl phthalate, 2-ethylhexyl decyl phthalate, EINECS 286-800-2, Phthalic acid, decyl 2-ethylhexyl ester, Decyl 2-ethylhexyl benzene-1,2-dicarboxylate
| Molecular Formula | C26H42O4 |
|---|---|
| Molecular Weight | 418.31 g/mol |
| LogP | 7.3573 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 418.30832 |
| Heavy Atoms | 30 |
| Complexity | 596.4513 |
Chemical Identifiers
| CAS Number | 85391-46-4 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC |
Product Overview
Decyl 2-ethylhexyl phthalate (CAS 85391-46-4), with molecular formula C26H42O4 and molecular weight 418.31 g/mol. IUPAC: 1-O-decyl 2-O-(2-ethylhexyl) benzene-1,2-dicarboxylate.
Chemical Property Profile of Decyl 2-ethylhexyl phthalate
Property Insights of Decyl 2-ethylhexyl phthalate
The XLogP value of 7.3573 indicates that Decyl 2-ethylhexyl 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, Decyl 2-ethylhexyl phthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decyl 2-ethylhexyl 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 Decyl 2-ethylhexyl phthalate?
The CAS number of Decyl 2-ethylhexyl phthalate is 85391-46-4.
What is the molecular formula of Decyl 2-ethylhexyl phthalate?
The molecular formula of Decyl 2-ethylhexyl phthalate is C26H42O4.
What is the molecular weight of Decyl 2-ethylhexyl phthalate?
The molecular weight of Decyl 2-ethylhexyl phthalate is 418.31 g/mol.
Where can I buy Decyl 2-ethylhexyl phthalate?
You can request a quote for Decyl 2-ethylhexyl phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decyl 2-ethylhexyl phthalate?
Yes, KEHONG BIO provides custom synthesis services for Decyl 2-ethylhexyl phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.