烯丙基仲丁基硫醚
TL;DR: 烯丙基仲丁基硫醚 (CAS 70289-07-5) 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.
烯丙基仲丁基硫醚
2-prop-2-enylsulfanylbutane
Also Known As: Allyl Sec-Butyl Sulfide, Sulfide, allyl sec-butyl,, 2-prop-2-enylsulfanylbutane, Allylsec-butylsulfide, 2-(Allylsulfanyl)butane
| Molecular Formula | C7H14S |
|---|---|
| Molecular Weight | 130.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 130.08162 |
| Heavy Atoms | 8 |
| Complexity | 59.0 |
Chemical Identifiers
| CAS Number | 70289-07-5 |
|---|---|
| SMILES | CCC(C)SCC=C |
| InChIKey | QLCUOCVKHIAUIL-UHFFFAOYSA-N |
Product Overview
烯丙基仲丁基硫醚 (CAS 70289-07-5), with molecular formula C7H14S and molecular weight 130.08 g/mol. IUPAC: 2-prop-2-enylsulfanylbutane.
Chemical Property Profile of 烯丙基仲丁基硫醚
Property Insights of 烯丙基仲丁基硫醚
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 烯丙基仲丁基硫醚. With a topological polar surface area (TPSA) of 25.3 Ų, 烯丙基仲丁基硫醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 烯丙基仲丁基硫醚 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 烯丙基仲丁基硫醚?
The CAS number of 烯丙基仲丁基硫醚 is 70289-07-5.
What is the molecular formula of 烯丙基仲丁基硫醚?
The molecular formula of 烯丙基仲丁基硫醚 is C7H14S.
What is the molecular weight of 烯丙基仲丁基硫醚?
The molecular weight of 烯丙基仲丁基硫醚 is 130.08 g/mol.
Where can I buy 烯丙基仲丁基硫醚?
You can request a quote for 烯丙基仲丁基硫醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 烯丙基仲丁基硫醚?
Yes, KEHONG BIO provides custom synthesis services for 烯丙基仲丁基硫醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.