CH2=C(CH3)-Sch3
TL;DR: CH2=C(CH3)-Sch3 (CAS 7594-44-7) is a chemical compound with molecular formula C4H8S and molecular weight 88.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylprop-1-ene
Also Known As: 2-(methylthio)propene, isopropenyl methyl sulfide, 2-methylsulfanylprop-1-ene, CH2=C(CH3)-SCH3, ITKBWZPRAFZVNW-UHFFFAOYSA-
| Molecular Formula | C4H8S |
|---|---|
| Molecular Weight | 88.03 g/mol |
| LogP | 1.883 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 88.03467 |
| Heavy Atoms | 5 |
| Complexity | 38.91261 |
Chemical Identifiers
| CAS Number | 7594-44-7 |
|---|---|
| SMILES | CC(=C)SC |
Product Overview
CH2=C(CH3)-Sch3 (CAS 7594-44-7), with molecular formula C4H8S and molecular weight 88.03 g/mol. IUPAC: 2-methylsulfanylprop-1-ene.
Chemical Property Profile of CH2=C(CH3)-Sch3
Property Insights of CH2=C(CH3)-Sch3
The XLogP value of 1.883 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CH2=C(CH3)-Sch3. With a topological polar surface area (TPSA) of 0.0 Ų, CH2=C(CH3)-Sch3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CH2=C(CH3)-Sch3 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 CH2=C(CH3)-Sch3?
The CAS number of CH2=C(CH3)-Sch3 is 7594-44-7.
What is the molecular formula of CH2=C(CH3)-Sch3?
The molecular formula of CH2=C(CH3)-Sch3 is C4H8S.
What is the molecular weight of CH2=C(CH3)-Sch3?
The molecular weight of CH2=C(CH3)-Sch3 is 88.03 g/mol.
Where can I buy CH2=C(CH3)-Sch3?
You can request a quote for CH2=C(CH3)-Sch3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CH2=C(CH3)-Sch3?
Yes, KEHONG BIO provides custom synthesis services for CH2=C(CH3)-Sch3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.