3-((2,2-Diethoxyethyl)thio)propene
TL;DR: 3-((2,2-Diethoxyethyl)thio)propene (CAS 84824-84-0) is a chemical compound with molecular formula C9H18O2S and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-diethoxyethylsulfanyl)prop-1-ene
Also Known As: Allyl(2,2-diethoxyethyl)sulfane, 3-((2,2-Diethoxyethyl)thio)propene, EINECS 284-236-1, 3-(2,2-diethoxyethylsulfanyl)prop-1-ene, 3-[(2,2-diethoxyethyl)thio]propene
| Molecular Formula | C9H18O2S |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 2.3047 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 190.10275 |
| Heavy Atoms | 12 |
| Complexity | 100.70166 |
Chemical Identifiers
| CAS Number | 84824-84-0 |
|---|---|
| SMILES | CCOC(CSCC=C)OCC |
Product Overview
3-((2,2-Diethoxyethyl)thio)propene (CAS 84824-84-0), with molecular formula C9H18O2S and molecular weight 190.10 g/mol. IUPAC: 3-(2,2-diethoxyethylsulfanyl)prop-1-ene.
Chemical Property Profile of 3-((2,2-Diethoxyethyl)thio)propene
Property Insights of 3-((2,2-Diethoxyethyl)thio)propene
The XLogP value of 2.3047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((2,2-Diethoxyethyl)thio)propene. With a topological polar surface area (TPSA) of 18.46 Ų, 3-((2,2-Diethoxyethyl)thio)propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((2,2-Diethoxyethyl)thio)propene has 0 hydrogen bond donor(s) and 3 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 3-((2,2-Diethoxyethyl)thio)propene?
The CAS number of 3-((2,2-Diethoxyethyl)thio)propene is 84824-84-0.
What is the molecular formula of 3-((2,2-Diethoxyethyl)thio)propene?
The molecular formula of 3-((2,2-Diethoxyethyl)thio)propene is C9H18O2S.
What is the molecular weight of 3-((2,2-Diethoxyethyl)thio)propene?
The molecular weight of 3-((2,2-Diethoxyethyl)thio)propene is 190.10 g/mol.
Where can I buy 3-((2,2-Diethoxyethyl)thio)propene?
You can request a quote for 3-((2,2-Diethoxyethyl)thio)propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((2,2-Diethoxyethyl)thio)propene?
Yes, KEHONG BIO provides custom synthesis services for 3-((2,2-Diethoxyethyl)thio)propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.