2-Methyl-1-methylsulfanylbut-2-ene
TL;DR: 2-Methyl-1-methylsulfanylbut-2-ene (CAS 89534-74-7) is a chemical compound with molecular formula C6H12S and molecular weight 116.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-methylsulfanylbut-2-ene
Also Known As: 2-methyl-1-methylsulfanylbut-2-ene, 2-METHYL-1-METHYLTHIO-2-BUTENE, Sulfide, methyl 2-methyl-2-butenyl, methyl (2-methyl-2-butenyl) sulfide, 2-METHYL-1-(METHYLSULFANYL)BUT-2-ENE
| Molecular Formula | C6H12S |
|---|---|
| Molecular Weight | 116.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 116.06597 |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 89534-74-7 |
|---|---|
| SMILES | CC=C(C)CSC |
| InChIKey | PBWZEERIWACABP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1-methylsulfanylbut-2-ene (CAS 89534-74-7), with molecular formula C6H12S and molecular weight 116.07 g/mol. IUPAC: 2-methyl-1-methylsulfanylbut-2-ene.
Chemical Property Profile of 2-Methyl-1-methylsulfanylbut-2-ene
Property Insights of 2-Methyl-1-methylsulfanylbut-2-ene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-methylsulfanylbut-2-ene. With a topological polar surface area (TPSA) of 25.3 Ų, 2-Methyl-1-methylsulfanylbut-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1-methylsulfanylbut-2-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 2-Methyl-1-methylsulfanylbut-2-ene?
The CAS number of 2-Methyl-1-methylsulfanylbut-2-ene is 89534-74-7.
What is the molecular formula of 2-Methyl-1-methylsulfanylbut-2-ene?
The molecular formula of 2-Methyl-1-methylsulfanylbut-2-ene is C6H12S.
What is the molecular weight of 2-Methyl-1-methylsulfanylbut-2-ene?
The molecular weight of 2-Methyl-1-methylsulfanylbut-2-ene is 116.07 g/mol.
Where can I buy 2-Methyl-1-methylsulfanylbut-2-ene?
You can request a quote for 2-Methyl-1-methylsulfanylbut-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-methylsulfanylbut-2-ene?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-methylsulfanylbut-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.