1-Methoxy-3-trimethylsilyloxy-1,3-butadiene
TL;DR: 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene (CAS 59414-23-2) is a chemical compound with molecular formula C8H16O2Si and molecular weight 172.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxybuta-1,3-dien-2-yloxy(trimethyl)silane
Also Known As: Danishefskys Diene, Danishefsky's diene, Dimethyl-boranylium, Silane, [(3-methoxy-1-methylene-2-propenyl)oxy]trimethyl-, 1-Methoxy-3-(trimethylsilyloxy)-1,3-butadiene
| Molecular Formula | C8H16O2Si |
|---|---|
| Molecular Weight | 172.09 g/mol |
| LogP | 2.51 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 172.09195 |
| Heavy Atoms | 11 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 59414-23-2 |
|---|---|
| SMILES | COC=CC(=C)O[Si](C)(C)C |
| InChIKey | SHALBPKEGDBVKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methoxy-3-trimethylsilyloxy-1,3-butadiene (CAS 59414-23-2), with molecular formula C8H16O2Si and molecular weight 172.09 g/mol. IUPAC: 4-methoxybuta-1,3-dien-2-yloxy(trimethyl)silane.
Chemical Property Profile of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene
Property Insights of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene
The XLogP value of 2.51 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene. With a topological polar surface area (TPSA) of 18.5 Ų, 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene 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-Methoxy-3-trimethylsilyloxy-1,3-butadiene?
The CAS number of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene is 59414-23-2.
What is the molecular formula of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene?
The molecular formula of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene is C8H16O2Si.
What is the molecular weight of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene?
The molecular weight of 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene is 172.09 g/mol.
Where can I buy 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene?
You can request a quote for 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.