邻苯二甲酸二异戊酯
TL;DR: 邻苯二甲酸二异戊酯 (CAS 605-50-5) is a chemical compound with molecular formula C18H26O4 and molecular weight 306.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻苯二甲酸二异戊酯
bis(3-methylbutyl) benzene-1,2-dicarboxylate
Also Known As: Diisopentyl phthalate, Isoamyl phthalate, Diisoamyl phthalate, Disoamyl phthalate, Palatinol DIPP
| Molecular Formula | C18H26O4 |
|---|---|
| Molecular Weight | 306.18 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 306.1831 |
| Heavy Atoms | 22 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 605-50-5 |
|---|---|
| SMILES | CC(C)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)C |
| InChIKey | JANBFCARANRIKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻苯二甲酸二异戊酯 (CAS 605-50-5), with molecular formula C18H26O4 and molecular weight 306.18 g/mol. IUPAC: bis(3-methylbutyl) benzene-1,2-dicarboxylate.
Chemical Property Profile of 邻苯二甲酸二异戊酯
Property Insights of 邻苯二甲酸二异戊酯
The XLogP value of 5.6 indicates that 邻苯二甲酸二异戊酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 邻苯二甲酸二异戊酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 邻苯二甲酸二异戊酯 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 邻苯二甲酸二异戊酯?
The CAS number of 邻苯二甲酸二异戊酯 is 605-50-5.
What is the molecular formula of 邻苯二甲酸二异戊酯?
The molecular formula of 邻苯二甲酸二异戊酯 is C18H26O4.
What is the molecular weight of 邻苯二甲酸二异戊酯?
The molecular weight of 邻苯二甲酸二异戊酯 is 306.18 g/mol.
Where can I buy 邻苯二甲酸二异戊酯?
You can request a quote for 邻苯二甲酸二异戊酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻苯二甲酸二异戊酯?
Yes, KEHONG BIO provides custom synthesis services for 邻苯二甲酸二异戊酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.