TL;DR: Octyl decyl phthalate (CAS 119-07-3) is a chemical compound with molecular formula C26H42O4 and molecular weight 418.30832 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C26H42O4 |
| Molecular Weight | 418.30832 g/mol |
| XLogP | 10.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 418.30832 Da |
| Heavy Atoms | 30 |
| Complexity | 435.0 |
| Melting Point | -40 °F (USCG, 1999) |
| Boiling Point | 462 °F at 4 mmHg (NTP, 1992) |
| Density | 0.972 to 0.976 (USCG, 1999) |
| Flash Point | 455 °F (NTP, 1992) |
| Vapor Pressure | 0.00000039 [mmHg] |
| Refractive Index | Index of refraction: 1.482 at 25 °C |
| 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/ |
| SMILES | CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC |
| InChIKey | LVAGMBHLXLZJKZ-UHFFFAOYSA-N |
The XLogP value of 10.1 indicates that Octyl 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, Octyl decyl phthalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octyl decyl phthalate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Octyl decyl phthalate is 119-07-3.
The molecular formula of Octyl decyl phthalate is C26H42O4.
The molecular weight of Octyl decyl phthalate is 418.30832 g/mol.
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