1,3-Dithiolane, 2-methyl-2-styryl-
TL;DR: 1,3-Dithiolane, 2-methyl-2-styryl- (CAS 57230-62-3) is a chemical compound with molecular formula C12H14S2 and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-[(E)-2-phenylethenyl]-1,3-dithiolane
Also Known As: 2-Methyl-2-styryl-1,3-dithiolane, 1,3-DITHIOLANE, 2-METHYL-2-STYRYL-, 2,2'-Bis-trimethylsilanyl-biphenyl, 2-methyl-2-(2-phenylethenyl)-1,3-dithiolane, 2-methyl-2-(2-phenylvinyl)-1,3-dithiolane
| Molecular Formula | C12H14S2 |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 3.896 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.0537 |
| Heavy Atoms | 14 |
| Complexity | 310.35342 |
Chemical Identifiers
| CAS Number | 57230-62-3 |
|---|---|
| SMILES | CC1(SCCS1)/C=C/C2=CC=CC=C2 |
Product Overview
1,3-Dithiolane, 2-methyl-2-styryl- (CAS 57230-62-3), with molecular formula C12H14S2 and molecular weight 222.05 g/mol. IUPAC: 2-methyl-2-[(E)-2-phenylethenyl]-1,3-dithiolane.
Chemical Property Profile of 1,3-Dithiolane, 2-methyl-2-styryl-
Property Insights of 1,3-Dithiolane, 2-methyl-2-styryl-
The XLogP value of 3.896 indicates that 1,3-Dithiolane, 2-methyl-2-styryl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Dithiolane, 2-methyl-2-styryl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dithiolane, 2-methyl-2-styryl- 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 1,3-Dithiolane, 2-methyl-2-styryl-?
The CAS number of 1,3-Dithiolane, 2-methyl-2-styryl- is 57230-62-3.
What is the molecular formula of 1,3-Dithiolane, 2-methyl-2-styryl-?
The molecular formula of 1,3-Dithiolane, 2-methyl-2-styryl- is C12H14S2.
What is the molecular weight of 1,3-Dithiolane, 2-methyl-2-styryl-?
The molecular weight of 1,3-Dithiolane, 2-methyl-2-styryl- is 222.05 g/mol.
Where can I buy 1,3-Dithiolane, 2-methyl-2-styryl-?
You can request a quote for 1,3-Dithiolane, 2-methyl-2-styryl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiolane, 2-methyl-2-styryl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiolane, 2-methyl-2-styryl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.