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5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene
TL;DR: 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene (CAS 698-07-7) is a chemical compound with molecular formula C8H10S2 and molecular weight 170.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene
Also Known As: 5-[bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene, 1,3-Cyclopentadiene, 5-[bis(methylthio)methylene]-, J1.150.431K, 1-[Bis(methylthio)methylene]-2,4-cyclopentadiene
| Molecular Formula | C8H10S2 |
|---|---|
| Molecular Weight | 170.02 g/mol |
| LogP | 3.05 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.0224 |
| Heavy Atoms | 10 |
| Complexity | 179.30313 |
Chemical Identifiers
| CAS Number | 698-07-7 |
|---|---|
| SMILES | CSC(=C1C=CC=C1)SC |
Product Overview
5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene (CAS 698-07-7), with molecular formula C8H10S2 and molecular weight 170.02 g/mol. IUPAC: 5-[bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene.
Chemical Property Profile of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene
Property Insights of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene
The XLogP value of 3.05 indicates that 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene has 0 hydrogen bond donor(s) and 2 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 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene?
The CAS number of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene is 698-07-7.
What is the molecular formula of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene?
The molecular formula of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene is C8H10S2.
What is the molecular weight of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene?
The molecular weight of 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene is 170.02 g/mol.
Where can I buy 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene?
You can request a quote for 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene?
Yes, KEHONG BIO provides custom synthesis services for 5-[Bis(methylsulfanyl)methylidene]cyclopenta-1,3-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.