1-Propene, 1,1-diethoxy-
TL;DR: 1-Propene, 1,1-diethoxy- (CAS 21504-43-8) is a chemical compound with molecular formula C7H14O2 and molecular weight 130.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethoxyprop-1-ene
Also Known As: 1-Propene, 1,1-diethoxy-, 1,1-diethoxyprop-1-ene, 1,1-diethoxypropene, 1,1-Diethoxy-1-propene, 1,1-di-ethoxyprop-1-ene
| Molecular Formula | C7H14O2 |
|---|---|
| Molecular Weight | 130.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 130.09938 |
| Heavy Atoms | 9 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 21504-43-8 |
|---|---|
| SMILES | CCOC(=CC)OCC |
| InChIKey | AKKQRBAJPYHABK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propene, 1,1-diethoxy- (CAS 21504-43-8), with molecular formula C7H14O2 and molecular weight 130.10 g/mol. IUPAC: 1,1-diethoxyprop-1-ene.
Chemical Property Profile of 1-Propene, 1,1-diethoxy-
Property Insights of 1-Propene, 1,1-diethoxy-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propene, 1,1-diethoxy-. With a topological polar surface area (TPSA) of 18.5 Ų, 1-Propene, 1,1-diethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propene, 1,1-diethoxy- has 0 hydrogen bond donor(s) and 2 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 1-Propene, 1,1-diethoxy-?
The CAS number of 1-Propene, 1,1-diethoxy- is 21504-43-8.
What is the molecular formula of 1-Propene, 1,1-diethoxy-?
The molecular formula of 1-Propene, 1,1-diethoxy- is C7H14O2.
What is the molecular weight of 1-Propene, 1,1-diethoxy-?
The molecular weight of 1-Propene, 1,1-diethoxy- is 130.10 g/mol.
Where can I buy 1-Propene, 1,1-diethoxy-?
You can request a quote for 1-Propene, 1,1-diethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propene, 1,1-diethoxy-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propene, 1,1-diethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.