cis-2,3-Dimethylthiirane
TL;DR: cis-2,3-Dimethylthiirane (CAS 5954-71-2) 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.
(2R,3S)-2,3-dimethylthiirane
Also Known As: cis-2,3-Dimethylthiirane, cis-Dimethylthiirane, (2r,3s)-2,3-dimethylthiirane, cisdimethylthiirane, cis-2-Butene sulfide
| Molecular Formula | C4H8S |
|---|---|
| Molecular Weight | 88.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 88.03467 |
| Heavy Atoms | 5 |
| Complexity | 36.0 |
Chemical Identifiers
| CAS Number | 5954-71-2 |
|---|---|
| SMILES | C[C@@H]1[C@@H](S1)C |
| InChIKey | ZMJBHCIEMIVIFZ-ZXZARUISSA-N |
Product Overview
cis-2,3-Dimethylthiirane (CAS 5954-71-2), with molecular formula C4H8S and molecular weight 88.03 g/mol. IUPAC: (2R,3S)-2,3-dimethylthiirane.
Chemical Property Profile of cis-2,3-Dimethylthiirane
Property Insights of cis-2,3-Dimethylthiirane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-2,3-Dimethylthiirane. With a topological polar surface area (TPSA) of 25.3 Ų, cis-2,3-Dimethylthiirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2,3-Dimethylthiirane 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 cis-2,3-Dimethylthiirane?
The CAS number of cis-2,3-Dimethylthiirane is 5954-71-2.
What is the molecular formula of cis-2,3-Dimethylthiirane?
The molecular formula of cis-2,3-Dimethylthiirane is C4H8S.
What is the molecular weight of cis-2,3-Dimethylthiirane?
The molecular weight of cis-2,3-Dimethylthiirane is 88.03 g/mol.
Where can I buy cis-2,3-Dimethylthiirane?
You can request a quote for cis-2,3-Dimethylthiirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-2,3-Dimethylthiirane?
Yes, KEHONG BIO provides custom synthesis services for cis-2,3-Dimethylthiirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.