1,1-Diethoxy-2-butene
TL;DR: 1,1-Diethoxy-2-butene (CAS 10602-34-3) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethoxybut-2-ene
Also Known As: 1,1-Diethoxybut-2-ene, 2-Butene, 1,1-diethoxy-, crotonaldehyde acetal, 2-Butenal diethyl acetal, 1,1-Diethoxy-2-butene
| Molecular Formula | C8H16O2 |
|---|---|
| Molecular Weight | 144.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 144.11504 |
| Heavy Atoms | 10 |
| Complexity | 83.0 |
Chemical Identifiers
| CAS Number | 10602-34-3 |
|---|---|
| SMILES | CCOC(C=CC)OCC |
| InChIKey | ZUMISMXLQDKQDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Diethoxy-2-butene (CAS 10602-34-3), with molecular formula C8H16O2 and molecular weight 144.12 g/mol. IUPAC: 1,1-diethoxybut-2-ene.
Chemical Property Profile of 1,1-Diethoxy-2-butene
Property Insights of 1,1-Diethoxy-2-butene
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Diethoxy-2-butene. With a topological polar surface area (TPSA) of 18.5 Ų, 1,1-Diethoxy-2-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Diethoxy-2-butene 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 1,1-Diethoxy-2-butene?
The CAS number of 1,1-Diethoxy-2-butene is 10602-34-3.
What is the molecular formula of 1,1-Diethoxy-2-butene?
The molecular formula of 1,1-Diethoxy-2-butene is C8H16O2.
What is the molecular weight of 1,1-Diethoxy-2-butene?
The molecular weight of 1,1-Diethoxy-2-butene is 144.12 g/mol.
Where can I buy 1,1-Diethoxy-2-butene?
You can request a quote for 1,1-Diethoxy-2-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Diethoxy-2-butene?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Diethoxy-2-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.