(E)-t-Butyl-1-propenylsulfide
TL;DR: (E)-t-Butyl-1-propenylsulfide (CAS 61866-00-0) is a chemical compound with molecular formula C7H14S and molecular weight 130.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-[(E)-prop-1-enyl]sulfanylpropane
Also Known As: (E)-t-Butyl-1-propenylsulfide, (E) t-Butyl-1-propenylsulfide, 2-methyl-2-prop-1-enylsulfanylpropane, 2-methyl-2-[(E)-prop-1-enyl]sulfanylpropane
| Molecular Formula | C7H14S |
|---|---|
| Molecular Weight | 130.08 g/mol |
| LogP | 3.0517 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 130.08162 |
| Heavy Atoms | 8 |
| Complexity | 76.87784 |
Chemical Identifiers
| CAS Number | 61866-00-0 |
|---|---|
| SMILES | C/C=C/SC(C)(C)C |
Product Overview
(E)-t-Butyl-1-propenylsulfide (CAS 61866-00-0), with molecular formula C7H14S and molecular weight 130.08 g/mol. IUPAC: 2-methyl-2-[(E)-prop-1-enyl]sulfanylpropane.
Chemical Property Profile of (E)-t-Butyl-1-propenylsulfide
Property Insights of (E)-t-Butyl-1-propenylsulfide
The XLogP value of 3.0517 indicates that (E)-t-Butyl-1-propenylsulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (E)-t-Butyl-1-propenylsulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-t-Butyl-1-propenylsulfide has 0 hydrogen bond donor(s) and 1 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 (E)-t-Butyl-1-propenylsulfide?
The CAS number of (E)-t-Butyl-1-propenylsulfide is 61866-00-0.
What is the molecular formula of (E)-t-Butyl-1-propenylsulfide?
The molecular formula of (E)-t-Butyl-1-propenylsulfide is C7H14S.
What is the molecular weight of (E)-t-Butyl-1-propenylsulfide?
The molecular weight of (E)-t-Butyl-1-propenylsulfide is 130.08 g/mol.
Where can I buy (E)-t-Butyl-1-propenylsulfide?
You can request a quote for (E)-t-Butyl-1-propenylsulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-t-Butyl-1-propenylsulfide?
Yes, KEHONG BIO provides custom synthesis services for (E)-t-Butyl-1-propenylsulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.