1-Propene, 2-methyl-1-(methylthio)-
TL;DR: 1-Propene, 2-methyl-1-(methylthio)- (CAS 52101-04-9) 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.
2-methyl-1-methylsulfanylprop-1-ene
Also Known As: 1-methylthio-t-butene, 2-methyl-1-(methylthio)propene, COQOFJMYYXLQHT-UHFFFAOYSA-, 1-Propene, 2-methyl-1-(methylthio)-, 1-(Methylthio)-2-methyl-1-propene
| Molecular Formula | C5H10S |
|---|---|
| Molecular Weight | 102.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 102.05032 |
| Heavy Atoms | 6 |
| Complexity | 51.0 |
Chemical Identifiers
| CAS Number | 52101-04-9 |
|---|---|
| SMILES | CC(=CSC)C |
| InChIKey | COQOFJMYYXLQHT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propene, 2-methyl-1-(methylthio)- (CAS 52101-04-9), with molecular formula C5H10S and molecular weight 102.05 g/mol. IUPAC: 2-methyl-1-methylsulfanylprop-1-ene.
Chemical Property Profile of 1-Propene, 2-methyl-1-(methylthio)-
Property Insights of 1-Propene, 2-methyl-1-(methylthio)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propene, 2-methyl-1-(methylthio)-. With a topological polar surface area (TPSA) of 25.3 Ų, 1-Propene, 2-methyl-1-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propene, 2-methyl-1-(methylthio)- 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 1-Propene, 2-methyl-1-(methylthio)-?
The CAS number of 1-Propene, 2-methyl-1-(methylthio)- is 52101-04-9.
What is the molecular formula of 1-Propene, 2-methyl-1-(methylthio)-?
The molecular formula of 1-Propene, 2-methyl-1-(methylthio)- is C5H10S.
What is the molecular weight of 1-Propene, 2-methyl-1-(methylthio)-?
The molecular weight of 1-Propene, 2-methyl-1-(methylthio)- is 102.05 g/mol.
Where can I buy 1-Propene, 2-methyl-1-(methylthio)-?
You can request a quote for 1-Propene, 2-methyl-1-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propene, 2-methyl-1-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propene, 2-methyl-1-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.