对薄荷-8-硫醇-3-酮
TL;DR: 对薄荷-8-硫醇-3-酮 (CAS 38462-22-5) is a chemical compound with molecular formula C10H18OS and molecular weight 186.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对薄荷-8-硫醇-3-酮
5-methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one
Also Known As: p-Mentha-8-thiol-3-one, 8-Mercaptomenthone, Thiomenthone, buchu mercaptan, buchu ketone
| Molecular Formula | C10H18OS |
|---|---|
| Molecular Weight | 186.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.10783 |
| Heavy Atoms | 12 |
| Complexity | 186.0 |
| Boiling Point | 56.00 to 62.00 °C. @ 0.10 mm Hg |
| Density | 0.995-1.010 |
| Solubility | insoluble in water soluble in alcohol |
| Refractive Index | 1.492-1.509 |
Chemical Identifiers
| CAS Number | 38462-22-5 |
|---|---|
| SMILES | CC1CCC(C(=O)C1)C(C)(C)S |
| InChIKey | RVOKNSFEAOYULQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对薄荷-8-硫醇-3-酮 (CAS 38462-22-5), with molecular formula C10H18OS and molecular weight 186.11 g/mol. IUPAC: 5-methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one.
Chemical Property Profile of 对薄荷-8-硫醇-3-酮
Property Insights of 对薄荷-8-硫醇-3-酮
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 对薄荷-8-硫醇-3-酮. With a topological polar surface area (TPSA) of 18.1 Ų, 对薄荷-8-硫醇-3-酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对薄荷-8-硫醇-3-酮 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 对薄荷-8-硫醇-3-酮?
The CAS number of 对薄荷-8-硫醇-3-酮 is 38462-22-5.
What is the molecular formula of 对薄荷-8-硫醇-3-酮?
The molecular formula of 对薄荷-8-硫醇-3-酮 is C10H18OS.
What is the molecular weight of 对薄荷-8-硫醇-3-酮?
The molecular weight of 对薄荷-8-硫醇-3-酮 is 186.11 g/mol.
Where can I buy 对薄荷-8-硫醇-3-酮?
You can request a quote for 对薄荷-8-硫醇-3-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对薄荷-8-硫醇-3-酮?
Yes, KEHONG BIO provides custom synthesis services for 对薄荷-8-硫醇-3-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.