5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole
TL;DR: 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole (CAS 97613-69-9) is a chemical compound with molecular formula C21H32O4 and molecular weight 348.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(9-ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole
Also Known As: 9-ethoxy-5,9-dimethyl-1-( -3-decene, 5-(9-ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole, 9-Ethoxy-5,9-dimethyl-1-((3,4-methylenedioxy)phenoxy)-3-decene
| Molecular Formula | C21H32O4 |
|---|---|
| Molecular Weight | 348.23 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 348.23007 |
| Heavy Atoms | 25 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 97613-69-9 |
|---|---|
| SMILES | CCOC(C)(C)CCCC(C)C=CCCOC1=CC2=C(C=C1)OCO2 |
| InChIKey | RZYIAWJNVBLJPH-UHFFFAOYSA-N |
Product Overview
5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole (CAS 97613-69-9), with molecular formula C21H32O4 and molecular weight 348.23 g/mol. IUPAC: 5-(9-ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole.
Chemical Property Profile of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole
Property Insights of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole
The XLogP value of 5.4 indicates that 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole 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 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole?
The CAS number of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole is 97613-69-9.
What is the molecular formula of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole?
The molecular formula of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole is C21H32O4.
What is the molecular weight of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole?
The molecular weight of 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole is 348.23 g/mol.
Where can I buy 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole?
You can request a quote for 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-(9-Ethoxy-5,9-dimethyldec-3-enoxy)-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.