3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide
TL;DR: 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide (CAS 1077-61-8) is a chemical compound with molecular formula C10H12O2S and molecular weight 196.0558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-3,4-dihydro-2H-thiochromene 1,1-dioxide
Also Known As: 6-methylthiochromane 1,1-dioxide, 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide, 6-methylthiochroman 1,1-dioxide, 6-methyl-3,4-dihydro-2H-thiochromene 1,1-dioxide, 3,4-Dihydro-6-methyl-2H-1-benzothiopyran1,1-dioxide
Technical Specifications
| Molecular Formula | C10H12O2S |
| Molecular Weight | 196.0558 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.0558 Da |
| Heavy Atoms | 13 |
| Complexity | 276.0 |
| SMILES | CC1=CC2=C(C=C1)S(=O)(=O)CCC2 |
| InChIKey | WSZWAAAVGHPCNK-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide
Property Insights of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide. With a topological polar surface area (TPSA) of 42.5 Ų, 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide 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
What is the CAS number of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide?
The CAS number of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide is 1077-61-8.
What is the molecular formula of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide?
The molecular formula of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide is C10H12O2S.
What is the molecular weight of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide?
The molecular weight of 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide is 196.0558 g/mol.
Where can I buy 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide?
You can request a quote for 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide?
Yes, CoreyChem provides custom synthesis services for 3,4-Dihydro-6-methyl-2H-1-benzothiopyran 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.