4,6-Dimethyl-4-thiochromanol
TL;DR: 4,6-Dimethyl-4-thiochromanol (CAS 478065-01-9) is a chemical compound with molecular formula C11H14OS and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-2,3-dihydrothiochromen-4-ol
Also Known As: 4,6-dimethyl-4-thiochromanol, 4,6-dimethylthiochroman-4-ol, 4,6-dimethyl-3,4-dihydro-2H-1-benzothiopyran-4-ol, 4,6-dimethyl-2,3-dihydrothiochromen-4-ol, 4,6-dimethyl-2,3-dihydro-1-benzothiopyran-4-ol
| Molecular Formula | C11H14OS |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | 2.69832 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.07654 |
| Heavy Atoms | 13 |
| Complexity | 330.8622 |
Chemical Identifiers
| CAS Number | 478065-01-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)SCCC2(C)O |
Product Overview
4,6-Dimethyl-4-thiochromanol (CAS 478065-01-9), with molecular formula C11H14OS and molecular weight 194.08 g/mol. IUPAC: 4,6-dimethyl-2,3-dihydrothiochromen-4-ol.
Chemical Property Profile of 4,6-Dimethyl-4-thiochromanol
Property Insights of 4,6-Dimethyl-4-thiochromanol
The XLogP value of 2.69832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dimethyl-4-thiochromanol. With a topological polar surface area (TPSA) of 20.23 Ų, 4,6-Dimethyl-4-thiochromanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dimethyl-4-thiochromanol has 1 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 4,6-Dimethyl-4-thiochromanol?
The CAS number of 4,6-Dimethyl-4-thiochromanol is 478065-01-9.
What is the molecular formula of 4,6-Dimethyl-4-thiochromanol?
The molecular formula of 4,6-Dimethyl-4-thiochromanol is C11H14OS.
What is the molecular weight of 4,6-Dimethyl-4-thiochromanol?
The molecular weight of 4,6-Dimethyl-4-thiochromanol is 194.08 g/mol.
Where can I buy 4,6-Dimethyl-4-thiochromanol?
You can request a quote for 4,6-Dimethyl-4-thiochromanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dimethyl-4-thiochromanol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dimethyl-4-thiochromanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.