4-(Methylsulfanyl)but-1-ene
TL;DR: 4-(Methylsulfanyl)but-1-ene (CAS 20582-83-6) is a chemical compound with molecular formula C5H10S and molecular weight 102.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanylbut-1-ene
Also Known As: 3-buten-1-yl methyl sulfide, 4-methylsulfanylbut-1-ene, 4-(Methylthio)-1-butene, CH3SCH2CH2CH=CH2, 4-(METHYLSULFANYL)BUT-1-ENE
| Molecular Formula | C5H10S |
|---|---|
| Molecular Weight | 102.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 102.05032 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
Chemical Identifiers
| CAS Number | 20582-83-6 |
|---|---|
| SMILES | CSCCC=C |
| InChIKey | KTYYHDZDBJAYQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Methylsulfanyl)but-1-ene (CAS 20582-83-6), with molecular formula C5H10S and molecular weight 102.05 g/mol. IUPAC: 4-methylsulfanylbut-1-ene.
Chemical Property Profile of 4-(Methylsulfanyl)but-1-ene
Property Insights of 4-(Methylsulfanyl)but-1-ene
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Methylsulfanyl)but-1-ene. With a topological polar surface area (TPSA) of 25.3 Ų, 4-(Methylsulfanyl)but-1-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Methylsulfanyl)but-1-ene 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 4-(Methylsulfanyl)but-1-ene?
The CAS number of 4-(Methylsulfanyl)but-1-ene is 20582-83-6.
What is the molecular formula of 4-(Methylsulfanyl)but-1-ene?
The molecular formula of 4-(Methylsulfanyl)but-1-ene is C5H10S.
What is the molecular weight of 4-(Methylsulfanyl)but-1-ene?
The molecular weight of 4-(Methylsulfanyl)but-1-ene is 102.05 g/mol.
Where can I buy 4-(Methylsulfanyl)but-1-ene?
You can request a quote for 4-(Methylsulfanyl)but-1-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Methylsulfanyl)but-1-ene?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methylsulfanyl)but-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.