邻苯二甲酸二(2-丙基庚)酯
TL;DR: 邻苯二甲酸二(2-丙基庚)酯 (CAS 53306-54-0) is a chemical compound with molecular formula C28H46O4 and molecular weight 446.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻苯二甲酸二(2-丙基庚)酯
bis(2-propylheptyl) benzene-1,2-dicarboxylate
Also Known As: Bis(2-propylheptyl) phthalate, Di-2-propylheptyl Phthalate, DPHP, Palatinol 10P, bis(2-propylheptyl)phthalate
| Molecular Formula | C28H46O4 |
|---|---|
| Molecular Weight | 446.34 g/mol |
| LogP | 9.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Exact Mass | 446.3396 |
| Heavy Atoms | 32 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 53306-54-0 |
|---|---|
| SMILES | CCCCCC(CCC)COC(=O)C1=CC=CC=C1C(=O)OCC(CCC)CCCCC |
| InChIKey | MTYUOIVEVPTXFX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻苯二甲酸二(2-丙基庚)酯 (CAS 53306-54-0), with molecular formula C28H46O4 and molecular weight 446.34 g/mol. IUPAC: bis(2-propylheptyl) benzene-1,2-dicarboxylate.
Chemical Property Profile of 邻苯二甲酸二(2-丙基庚)酯
Property Insights of 邻苯二甲酸二(2-丙基庚)酯
The XLogP value of 9.6 indicates that 邻苯二甲酸二(2-丙基庚)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, 邻苯二甲酸二(2-丙基庚)酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 邻苯二甲酸二(2-丙基庚)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 邻苯二甲酸二(2-丙基庚)酯?
The CAS number of 邻苯二甲酸二(2-丙基庚)酯 is 53306-54-0.
What is the molecular formula of 邻苯二甲酸二(2-丙基庚)酯?
The molecular formula of 邻苯二甲酸二(2-丙基庚)酯 is C28H46O4.
What is the molecular weight of 邻苯二甲酸二(2-丙基庚)酯?
The molecular weight of 邻苯二甲酸二(2-丙基庚)酯 is 446.34 g/mol.
Where can I buy 邻苯二甲酸二(2-丙基庚)酯?
You can request a quote for 邻苯二甲酸二(2-丙基庚)酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻苯二甲酸二(2-丙基庚)酯?
Yes, KEHONG BIO provides custom synthesis services for 邻苯二甲酸二(2-丙基庚)酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.