3-Methanesulfinylaniline
TL;DR: 3-Methanesulfinylaniline (CAS 39082-89-8) is a chemical compound with molecular formula C7H9NOS and molecular weight 155.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfinylaniline
Also Known As: 3-methanesulfinylaniline, 3-methylsulfinylaniline, 3-(methylsulfinyl)aniline, 3-(methylsulfinyl)phenylamine, 3-(methylsulfinyl)Benzenamine
| Molecular Formula | C7H9NOS |
|---|---|
| Molecular Weight | 155.04 g/mol |
| LogP | 1.0062 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.04048 |
| Heavy Atoms | 10 |
| Complexity | 259.53796 |
Chemical Identifiers
| CAS Number | 39082-89-8 |
|---|---|
| SMILES | CS(=O)C1=CC=CC(=C1)N |
Product Overview
3-Methanesulfinylaniline (CAS 39082-89-8), with molecular formula C7H9NOS and molecular weight 155.04 g/mol. IUPAC: 3-methylsulfinylaniline.
Chemical Property Profile of 3-Methanesulfinylaniline
Property Insights of 3-Methanesulfinylaniline
The XLogP value of 1.0062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methanesulfinylaniline. With a topological polar surface area (TPSA) of 43.09 Ų, 3-Methanesulfinylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methanesulfinylaniline 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 3-Methanesulfinylaniline?
The CAS number of 3-Methanesulfinylaniline is 39082-89-8.
What is the molecular formula of 3-Methanesulfinylaniline?
The molecular formula of 3-Methanesulfinylaniline is C7H9NOS.
What is the molecular weight of 3-Methanesulfinylaniline?
The molecular weight of 3-Methanesulfinylaniline is 155.04 g/mol.
Where can I buy 3-Methanesulfinylaniline?
You can request a quote for 3-Methanesulfinylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methanesulfinylaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Methanesulfinylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.