甲基苯基亚砜
TL;DR: 甲基苯基亚砜 (CAS 1193-82-4) is a chemical compound with molecular formula C7H8OS and molecular weight 140.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基苯基亚砜
methylsulfinylbenzene
Also Known As: METHYL PHENYL SULFOXIDE, (Methylsulfinyl)benzene, methylsulfinylbenzene, Benzene, (methylsulfinyl)-, Thioanisole S-oxide
| Molecular Formula | C7H8OS |
|---|---|
| Molecular Weight | 140.03 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.02959 |
| Heavy Atoms | 9 |
| Complexity | 105.0 |
| Vapor Pressure | 0.02 [mmHg] |
Chemical Identifiers
| CAS Number | 1193-82-4 |
|---|---|
| SMILES | CS(=O)C1=CC=CC=C1 |
| InChIKey | JXTGICXCHWMCPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基苯基亚砜 (CAS 1193-82-4), with molecular formula C7H8OS and molecular weight 140.03 g/mol. IUPAC: methylsulfinylbenzene.
Chemical Property Profile of 甲基苯基亚砜
Property Insights of 甲基苯基亚砜
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基苯基亚砜. With a topological polar surface area (TPSA) of 36.3 Ų, 甲基苯基亚砜 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基苯基亚砜 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
Frequently Asked Questions
What is the CAS number of 甲基苯基亚砜?
The CAS number of 甲基苯基亚砜 is 1193-82-4.
What is the molecular formula of 甲基苯基亚砜?
The molecular formula of 甲基苯基亚砜 is C7H8OS.
What is the molecular weight of 甲基苯基亚砜?
The molecular weight of 甲基苯基亚砜 is 140.03 g/mol.
Where can I buy 甲基苯基亚砜?
You can request a quote for 甲基苯基亚砜 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基苯基亚砜?
Yes, KEHONG BIO provides custom synthesis services for 甲基苯基亚砜 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.