草酸二戊酯
TL;DR: 草酸二戊酯 (CAS 20602-86-2) is a chemical compound with molecular formula C12H22O4 and molecular weight 230.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
草酸二戊酯
dipentyl oxalate
Also Known As: Dipentyl oxalate, diamyl oxalate, dipentyloxalate, amyl oxalate, n-Pentyloxalat
| Molecular Formula | C12H22O4 |
|---|---|
| Molecular Weight | 230.15 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 230.15181 |
| Heavy Atoms | 16 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 20602-86-2 |
|---|---|
| SMILES | CCCCCOC(=O)C(=O)OCCCCC |
| InChIKey | XAHVPYNDLCTDTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
草酸二戊酯 (CAS 20602-86-2), with molecular formula C12H22O4 and molecular weight 230.15 g/mol. IUPAC: dipentyl oxalate.
Chemical Property Profile of 草酸二戊酯
Property Insights of 草酸二戊酯
The XLogP value of 3.4 indicates that 草酸二戊酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 草酸二戊酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 草酸二戊酯 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 草酸二戊酯?
The CAS number of 草酸二戊酯 is 20602-86-2.
What is the molecular formula of 草酸二戊酯?
The molecular formula of 草酸二戊酯 is C12H22O4.
What is the molecular weight of 草酸二戊酯?
The molecular weight of 草酸二戊酯 is 230.15 g/mol.
Where can I buy 草酸二戊酯?
You can request a quote for 草酸二戊酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 草酸二戊酯?
Yes, KEHONG BIO provides custom synthesis services for 草酸二戊酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.