邻苯二甲酸正辛正癸酯
TL;DR: 邻苯二甲酸正辛正癸酯 (CAS 119-07-3) 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.
邻苯二甲酸正辛正癸酯
2-O-decyl 1-O-octyl benzene-1,2-dicarboxylate
Also Known As: Decyl octyl phthalate, OCTYL DECYL PHTHALATE, Polycizer 532, Polycizer 562, Dinopol 235
| Molecular Formula | C26H42O4 |
|---|---|
| Molecular Weight | 418.31 g/mol |
| LogP | 10.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 418.30832 |
| Heavy Atoms | 30 |
| Complexity | 435.0 |
| Melting Point | -40.0 °C |
| Boiling Point | 238.9 °C at 4 mmHg |
| Density | 0.972 to 0.976 |
| Solubility | Phthalate esters are soluble to various extents in many common organic solvents and oils, but have a relatively low solubility in water. /Phthalate esters/ |
| Flash Point | 235.0 °C |
| Vapor Pressure | 0.00000039 [mmHg] |
| Refractive Index | 1.482 at 25 °C |
Chemical Identifiers
| CAS Number | 119-07-3 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC |
| InChIKey | LVAGMBHLXLZJKZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻苯二甲酸正辛正癸酯 (CAS 119-07-3), with molecular formula C26H42O4 and molecular weight 418.31 g/mol. IUPAC: 2-O-decyl 1-O-octyl benzene-1,2-dicarboxylate.
Chemical Property Profile of 邻苯二甲酸正辛正癸酯
Property Insights of 邻苯二甲酸正辛正癸酯
The XLogP value of 10.1 indicates that 邻苯二甲酸正辛正癸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 邻苯二甲酸正辛正癸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 邻苯二甲酸正辛正癸酯 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 邻苯二甲酸正辛正癸酯?
The CAS number of 邻苯二甲酸正辛正癸酯 is 119-07-3.
What is the molecular formula of 邻苯二甲酸正辛正癸酯?
The molecular formula of 邻苯二甲酸正辛正癸酯 is C26H42O4.
What is the molecular weight of 邻苯二甲酸正辛正癸酯?
The molecular weight of 邻苯二甲酸正辛正癸酯 is 418.31 g/mol.
Where can I buy 邻苯二甲酸正辛正癸酯?
You can request a quote for 邻苯二甲酸正辛正癸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻苯二甲酸正辛正癸酯?
Yes, KEHONG BIO provides custom synthesis services for 邻苯二甲酸正辛正癸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.