3,4-Dimethylthiophene-2,5-dicarbonitrile
TL;DR: 3,4-Dimethylthiophene-2,5-dicarbonitrile (CAS 155632-41-0) is a chemical compound with molecular formula C8H6N2S and molecular weight 162.02516 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-dimethylthiophene-2,5-dicarbonitrile
Also Known As: 3,4-dimethylthiophene-2,5-dicarbonitrile, 2,5-Dicyano-3,4-dimethylthiophene, dimethylthiophene-2,5-dicarbonitrile, 3,4-dimethyl-2,5-thiophenedicarbonitrile, 2,5-Thiophenedicarbonitrile,3,4-dimethyl-
Technical Specifications
| Molecular Formula | C8H6N2S |
| Molecular Weight | 162.02516 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 75.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.02516 Da |
| Heavy Atoms | 11 |
| Complexity | 217.0 |
| SMILES | CC1=C(SC(=C1C)C#N)C#N |
| InChIKey | KJJOQVQJRGSFGU-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dimethylthiophene-2,5-dicarbonitrile
Property Insights of 3,4-Dimethylthiophene-2,5-dicarbonitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethylthiophene-2,5-dicarbonitrile. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dimethylthiophene-2,5-dicarbonitrile. Following Lipinski's Rule of Five, 3,4-Dimethylthiophene-2,5-dicarbonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4-Dimethylthiophene-2,5-dicarbonitrile?
The CAS number of 3,4-Dimethylthiophene-2,5-dicarbonitrile is 155632-41-0.
What is the molecular formula of 3,4-Dimethylthiophene-2,5-dicarbonitrile?
The molecular formula of 3,4-Dimethylthiophene-2,5-dicarbonitrile is C8H6N2S.
What is the molecular weight of 3,4-Dimethylthiophene-2,5-dicarbonitrile?
The molecular weight of 3,4-Dimethylthiophene-2,5-dicarbonitrile is 162.02516 g/mol.
Where can I buy 3,4-Dimethylthiophene-2,5-dicarbonitrile?
You can request a quote for 3,4-Dimethylthiophene-2,5-dicarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dimethylthiophene-2,5-dicarbonitrile?
Yes, CoreyChem provides custom synthesis services for 3,4-Dimethylthiophene-2,5-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.