Propyl isome
TL;DR: Propyl isome (CAS 83-59-0) is a chemical compound with molecular formula C20H26O6 and molecular weight 362.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate
Also Known As: PROPYL ISOME, Propilizom, n-Propyl isome, Propilizon, n-Propylisome
| Molecular Formula | C20H26O6 |
|---|---|
| Molecular Weight | 362.17 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.17294 |
| Heavy Atoms | 26 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 83-59-0 |
|---|---|
| SMILES | CCCOC(=O)C1C(CC2=CC3=C(C=C2C1C(=O)OCCC)OCO3)C |
| InChIKey | UEKQGZQLUMSLNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propyl isome (CAS 83-59-0), with molecular formula C20H26O6 and molecular weight 362.17 g/mol. IUPAC: dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate.
Chemical Property Profile of Propyl isome
Property Insights of Propyl isome
The XLogP value of 4.0 indicates that Propyl isome is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl isome. Following Lipinski's Rule of Five, Propyl isome has 0 hydrogen bond donor(s) and 6 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 Propyl isome?
The CAS number of Propyl isome is 83-59-0.
What is the molecular formula of Propyl isome?
The molecular formula of Propyl isome is C20H26O6.
What is the molecular weight of Propyl isome?
The molecular weight of Propyl isome is 362.17 g/mol.
Where can I buy Propyl isome?
You can request a quote for Propyl isome directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl isome?
Yes, KEHONG BIO provides custom synthesis services for Propyl isome and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.